file int64 | a float64 | siga float64 | b float64 | sigb float64 | c float64 | sigc float64 | alpha float64 | sigalpha float64 | beta float64 | sigbeta float64 | gamma float64 | siggamma float64 | vol float64 | sigvol float64 | celltemp float64 | sigcelltemp float64 | diffrtemp float64 | sigdiffrtemp float64 | cellpressure float64 | sigcellpressure float64 | diffrpressure float64 | sigdiffrpressure float64 | thermalhist string | pressurehist string | compoundsource string | nel string | sg string | sgHall string | sgNumber int64 | commonname string | chemname string | mineral string | formula string | calcformula string | cellformula string | Z int64 | Zprime float64 | acce_code string | authors string | title string | journal string | year int64 | volume int64 | issue string | firstpage string | lastpage string | doi string | method string | radiation string | wavelength float64 | radType string | radSymbol string | Rall float64 | Robs float64 | Rref float64 | wRall float64 | wRobs float64 | wRref float64 | RFsqd float64 | RI float64 | gofall float64 | gofobs float64 | gofgt float64 | gofref float64 | duplicateof int64 | optimal int64 | status string | flags string | text string | svnrevision int64 | date string | time string | onhold string | cif_text string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,007,659 | 10.892 | 0.006 | 15.82 | 0.01 | 8.223 | 0.003 | 90 | null | 98.55 | 0.04 | 90 | null | 1,401.2 | 1.3 | 293 | null | 293 | null | null | null | null | null | 3 | P 1 21/a 1 | -P 2yab | 14 | 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-15(1),17-diene-16,19-dione | - C14 H18 O7 - | - C14 H18 O7 - | - C56 H72 O28 - | 4 | 1 | OA1046 | Akihiko Tsuda; Tatsuya Kawamoto; Takumi Oshima | 2,3-Benzoquino[15]crown-5 | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1362 | 1364 | 10.1107/S010827019800287X | 0.71073 | MoKα | null | 0.061 | null | null | 0.063 | null | null | null | null | 1.316 | 1.316 | null | null | null | has coordinates | Akihiko Tsuda; Tatsuya Kawamoto; Takumi Oshima
2,3-Benzoquino[15]crown-5
Acta Crystallographica Section C
54(9)
(1998)
1362-1364 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,660 | 28.021 | 0.005 | 17.118 | 0.004 | 12.11 | 0.002 | 90 | null | 90.44 | 0.02 | 90 | null | 5,809 | 2 | 295 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | Bis[μ-methylenebis(dicyclohexylphosphine)- P:P']bis[chloropalladium(I)](Pd—Pd) Bis(acetonitrile) Solvate | - C54 H98 Cl2 N2 P4 Pd2 - | - C54 H98 Cl2 N2 P4 Pd2 - | - C216 H392 Cl8 N8 P16 Pd8 - | 4 | 1 | OA1051 | Hashioka, Miho; Sakai, Ken; Tsubomura, Taro | Bis[μ-methylenebis(dicyclohexylphosphine)-<i>P</i>:<i>P</i>']bis[chloropalladium(I)](<i>Pd</i>—<i>Pd</i>) Diacetonitrile Solvate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1244 | 1247 | 10.1107/S0108270198004521 | 0.71069 | MoKα | 0.16 | 0.064 | null | 0.184 | 0.121 | null | null | null | 1.034 | 1.069 | 1.069 | null | null | null | has coordinates,has Fobs | Hashioka, Miho; Sakai, Ken; Tsubomura, Taro
Bis[μ-methylenebis(dicyclohexylphosphine)-<i>P</i>:<i>P</i>']bis[chloropalladium(I)](<i>Pd</i>—<i>Pd</i>) Diacetonitrile Solvate
Acta Crystallographica Section C
54(9)
(1998)
1244-1247 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
#$Revision: 198601 $
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2,007,661 | 11.776 | 0.006 | 3.918 | 0.002 | 10.189 | 0.007 | 90 | null | 100.59 | 0.04 | 90 | null | 462.1 | 0.5 | 293 | null | 293 | null | null | null | null | null | 3 | C 1 2/m 1 | -C 2y | 12 | - Li3 O13 V6 - | - Li4 O13 V6 - | - Li8 O26 V12 - | 2 | 0.25 | OS1007 | Bergström, Örjan; Gustafsson, Torbjörn; Thomas, John O. | Electrochemically Lithiated Vanadium Oxide, Li~3~V~6~O~13~ | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1204 | 1206 | 10.1107/S0108270198004211 | 0.71073 | MolybdenumKᾱ | 0.095 | 0.095 | null | 0.082 | 0.082 | null | null | null | 1.69 | 1.69 | 1.69 | null | null | null | has coordinates | Bergström, Örjan; Gustafsson, Torbjörn; Thomas, John O.
Electrochemically Lithiated Vanadium Oxide, Li~3~V~6~O~13~
Acta Crystallographica Section C
54(9)
(1998)
1204-1206 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,229,974 | 32.741 | 0.004 | 10.9198 | 0.0014 | 8.1228 | 0.001 | 90 | null | 95.92 | 0.02 | 90 | null | 2,888.6 | 0.6 | 113 | 2 | 113 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | 2-Benzyl-6-benzyloxypyridazin-3(2<i>H</i>)-one | - C18 H16 N2 O2 - | - C18 H16 N2 O2 - | - C144 H128 N16 O16 - | 8 | 1 | FJ2404 | Ju, Zhi-Yu; Jiang, Wan-Xiang; Yang, Feng-Ling | 2-Benzyl-6-benzyloxypyridazin-3(2<i>H</i>)-one | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1042 | 10.1107/S1600536811011597 | 0.71073 | MoKα | 0.0697 | 0.0468 | null | null | 0.1011 | 0.1161 | null | null | null | null | null | 0.951 | null | null | has coordinates,has Fobs | Ju, Zhi-Yu; Jiang, Wan-Xiang; Yang, Feng-Ling
2-Benzyl-6-benzyloxypyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E
67(5)
(2011)
o1042 | 301,805 | 2025-08-19 | 13:58:40 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
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2,007,662 | 7.5815 | 0.0008 | 9.9861 | 0.0009 | 10.2413 | 0.0012 | 78.417 | 0.009 | 88.559 | 0.009 | 71.491 | 0.008 | 719.66 | 0.14 | 298 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C26 H24 Co N6 O12 - | - C26 H24 Co N6 O12 - | - C26 H24 Co N6 O12 - | 1 | 0.5 | OS1013 | Hökelek, Tuncer; Necefoğlu, Hacalı | <i>trans</i>-Diaquabis(nicotinamide-<i>N</i>^1^)bis(4-nitrobenzoato-<i>O</i>)cobalt(II) | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1242 | 1244 | 10.1107/S0108270198004533 | 0.71073 | MoKα | null | 0.037 | null | null | 0.046 | null | null | null | null | 1.03 | 1.03 | null | null | null | has coordinates | Hökelek, Tuncer; Necefoğlu, Hacalı
<i>trans</i>-Diaquabis(nicotinamide-<i>N</i>^1^)bis(4-nitrobenzoato-<i>O</i>)cobalt(II)
Acta Crystallographica Section C
54(9)
(1998)
1242-1244 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,663 | 9.92 | 0.002 | 10.631 | 0.002 | 19.413 | 0.004 | 90 | null | 92.35 | 0.03 | 90 | null | 2,045.6 | 0.7 | 193 | 2 | 193 | 2 | null | null | null | null | 7 | P 1 2/c 1 | -P 2yc | 13 | Octakis(dimethylsulfoxide-O)gadolinium(III) hexacyanoferrate(III) | - C22 H48 Fe Gd N6 O8 S8 - | - C22 H48 Fe Gd N6 O8 S8 - | - C44 H96 Fe2 Gd2 N12 O16 S16 - | 2 | 0.5 | OS1014 | Martti Klinga; Rafael Cuesta; José María Moreno; José Manuel Dominguez-Vera; Enrique Colacio; Raikko Kivekäs | Octakis(dimethyl sulfoxide-<i>O</i>)gadolinium(III) Hexacyanoferrate(III) | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1275 | 1277 | 10.1107/S0108270198004545 | 0.71073 | MoKα | 0.065 | 0.052 | null | 0.121 | 0.116 | null | null | null | 1.169 | 1.213 | 1.213 | null | null | null | has coordinates | Martti Klinga; Rafael Cuesta; José María Moreno; José Manuel Dominguez-Vera; Enrique Colacio; Raikko Kivekäs
Octakis(dimethyl sulfoxide-<i>O</i>)gadolinium(III) Hexacyanoferrate(III)
Acta Crystallographica Section C
54(9)
(1998)
1275-1277 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
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2,007,664 | 18.116 | 0.002 | 18.601 | 0.002 | 18.503 | 0.003 | 90 | null | 95.87 | 0.01 | 90 | null | 6,202.4 | 1.4 | 294.2 | null | 294 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - Ce H60 Na8 O66 W10 - | - Ce Na8 O66 W10 - | - Ce4 Na32 O264 W40 - | 4 | 0.5 | QA0047 | Rosu, Cristina; Weakley, Timothy J. R. | Redetermination of Sodium [Bis(pentatungstato)cerate(IV)](8 ‒) 30-Hydrate, Na~8~[Ce(W~5~O~18~)~2~].30H~2~O | Acta Crystallographica Section C | 1,998 | 54 | 9 | IUC9800047 | 10.1107/S0108270198099363 | 0.71073 | MoKα | null | 0.047 | null | null | 0.055 | null | null | null | null | null | null | 2.14 | null | null | has coordinates,has Fobs | Rosu, Cristina; Weakley, Timothy J. R.
Redetermination of Sodium [Bis(pentatungstato)cerate(IV)](8 ‒) 30-Hydrate, Na~8~[Ce(W~5~O~18~)~2~].30H~2~O
Acta Crystallographica Section C
54(9)
(1998)
IUC9800047 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
#$Revision: 198601 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007664.cif $
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2,007,665 | 9.1202 | 0.0005 | 14.743 | 0.0008 | 17.7793 | 0.0009 | 90 | null | 102.389 | 0.001 | 90 | null | 2,334.9 | 0.2 | 173 | 2 | 173 | 2 | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | (N,N,N',N'-Tetramethylethylenediamine-N,N')bis(1,1,1,5,5,5- hexafluoropentane-2,4-dionato-O,O')iron(II) | - C16 H18 F12 Fe N2 O4 - | - C16 H18 F12 Fe N2 O4 - | - C64 H72 F48 Fe4 N8 O16 - | 4 | 0.5 | QA0049 | Dickman, Michael H. | (<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediamine-<i>N</i>,<i>N</i>')bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II) | Acta Crystallographica Section C | 1,998 | 54 | 9 | IUC9800048 | 10.1107/S010827019809934X | 0.71073 | MoKα | 0.044 | 0.037 | null | null | null | 0.098 | null | null | null | null | null | 1.04 | null | null | has coordinates | Dickman, Michael H.
(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediamine-<i>N</i>,<i>N</i>')bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-<i>O</i>,<i>O</i>')iron(II)
Acta Crystallographica Section C
54(9)
(1998)
IUC9800048 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,666 | 14.028 | 0.001 | 8.6312 | 0.0006 | 20.615 | 0.002 | 90 | null | 108.21 | 0.01 | 90 | null | 2,371 | 0.4 | 294 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Tetra-n-butylammonium Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II) | - C40 H72 N6 Ni S4 - | - C40 H72 N6 Ni S4 - | - C80 H144 N12 Ni2 S8 - | 2 | 0.5 | QB0057 | Dong, Gang; Fronczek, Frank R.; Watkins, Steven F.; Bernal, Ivan | Bis(tetra-<i>n</i>-butylammonium) Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II) | Acta Crystallographica Section C | 1,998 | 54 | 9 | IUC9800045 | 10.1107/S0108270198099351 | 1.54184 | CuKα | null | 0.061 | null | null | 0.057 | null | null | null | null | 1.447 | 1.447 | null | null | null | has coordinates,has Fobs | Dong, Gang; Fronczek, Frank R.; Watkins, Steven F.; Bernal, Ivan
Bis(tetra-<i>n</i>-butylammonium) Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II)
Acta Crystallographica Section C
54(9)
(1998)
IUC9800045 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007666.cif $
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2,007,667 | 7.822 | 0.001 | 7.822 | 0.001 | 7.822 | 0.001 | 90 | null | 90 | null | 90 | null | 478.58 | 0.11 | 173 | 2 | 173 | 2 | null | null | null | null | 3 | P a -3 | -P 2ac 2ab 3 | 205 | Strontium Nitrate | - N2 O6 Sr - | - N2 O6 Sr - | - N8 O24 Sr4 - | 4 | 0.166667 | QB0061 | El-Bali, Brahim; Bolte, Michael | Sr(NO~3~)~2~ at 173K | Acta Crystallographica Section C | 1,998 | 54 | 9 | IUC9800046 | 10.1107/S0108270198099375 | 0.71073 | MoKα | 0.0292 | 0.0226 | null | null | null | 0.0549 | null | null | null | null | null | 1.246 | null | null | has coordinates,has Fobs | El-Bali, Brahim; Bolte, Michael
Sr(NO~3~)~2~ at 173K
Acta Crystallographica Section C
54(9)
(1998)
IUC9800046 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,668 | 5.7747 | 0.0014 | 8.4689 | 0.0011 | 9.923 | 0.003 | 64.77 | 0.02 | 82.75 | 0.02 | 81.43 | 0.02 | 433 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 | P 1 | 1 | Mono carbo aluminate | - C H22 Al2 Ca4 O20 - | - C H22 Al2 Ca4 O20 - | - C H22 Al2 Ca4 O20 - | 1 | 1 | Michel Francois; Guillaume Renaudin; Omer Evrard | A Cementitious Compound with Composition 3CaO.Al~2~O~3~.CaCO~3~.11H~2~O | Acta Crystallographica Section C | 1,998 | 54 | 1214 | 1217 | null | null | 0.0268 | null | null | 0.0805 | null | null | null | null | null | null | null | 1,000,459 | null | has coordinates | Michel Francois; Guillaume Renaudin; Omer Evrard
A Cementitious Compound with Composition 3CaO.Al~2~O~3~.CaCO~3~.11H~2~O
Acta Crystallographica Section C
54
(1998)
1214-1217 | 287,519 | 2023-11-10 | 19:29:21 | #------------------------------------------------------------------------------
#$Date: 2023-11-10 21:21:08 +0200 (Fri, 10 Nov 2023) $
#$Revision: 287519 $
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2,229,973 | 20.5253 | 0.0007 | 13.5716 | 0.0004 | 20.3129 | 0.0007 | 90 | null | 119.205 | 0.001 | 90 | null | 4,939.1 | 0.3 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | (2-Methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^2^<i>O</i>^3^,<i>O</i>^4^)bis(triphenylphosphane-κ<i>P</i>)copper(I)–triphenylphosphane–methanol (1/1/1) | - C61 H54 Cu O4 P3 - | - C61 H54 Cu O4 P3 - | - C244 H216 Cu4 O16 P12 - | 4 | 1 | FI2105 | Muller, Fabian M. A.; Muller, Theunis J.; Steyl, Gideon | (2-Methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^2^<i>O</i>^3^,<i>O</i>^4^)bis(triphenylphosphane-κ<i>P</i>)copper(I)–triphenylphosphane–methanol (1/1/1) | Acta Crystallographica Section E | 2,011 | 67 | 5 | m581 | m582 | 10.1107/S1600536811011470 | 0.71073 | MoKα | 0.0695 | 0.0486 | null | null | null | 0.1268 | null | null | null | null | null | 1.055 | null | null | has coordinates,has Fobs | Muller, Fabian M. A.; Muller, Theunis J.; Steyl, Gideon
(2-Methyl-4-oxo-4<i>H</i>-pyran-3-olato-κ^2^<i>O</i>^3^,<i>O</i>^4^)bis(triphenylphosphane-κ<i>P</i>)copper(I)–triphenylphosphane–methanol (1/1/1)
Acta Crystallographica Section E
67(5)
(2011)
m581-m582 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
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2,007,669 | 9.9403 | 0.0006 | 25.4021 | 0.0014 | 10.587 | 0.0005 | 90 | null | 91.808 | 0.005 | 90 | null | 2,671.9 | 0.3 | 294 | 1 | 294 | 1 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | (2S,4S,5R)-(-)-2-(1H-Imidazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine | - C14 H17 N3 O - | - C14 H17 N3 O - | - C112 H136 N24 O8 - | 8 | 4 | SK1179 | Gallagher, John F.; Briody, John M.; Cantwell, Brendan P. | N—H···N Hydrogen Bonding in the Four Independent Molecules of (2<i>S</i>,4<i>S</i>,5<i>R</i>)-({-})-2-(1<i>H</i>-Imidazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine, with C-H···π~arene~, C-H···O and C-H···π~C=C~ Interactions | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1331 | 1335 | 10.1107/S0108270198004089 | 0.71073 | MoKα | 0.068 | 0.038 | null | null | null | 0.088 | null | null | null | null | null | 1.009 | null | null | has coordinates | Gallagher, John F.; Briody, John M.; Cantwell, Brendan P.
N—H···N Hydrogen Bonding in the Four Independent Molecules of (2<i>S</i>,4<i>S</i>,5<i>R</i>)-({-})-2-(1<i>H</i>-Imidazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine, with C-H···π~arene~, C-H···O and C-H···π~C=C~ Interactions
Acta Crystallographica Section C
54(... | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
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2,007,670 | 6.189 | 0.001 | 10.614 | 0.001 | 16.16 | 0.001 | 90 | null | 100.993 | 0.004 | 90 | null | 1,042.1 | 0.2 | 292 | 2 | 292 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | (1S)-phenyl-1-[(2S)-(3,5-dinitrobenzoyloxy)-propyl]-(2R)-methyl cyclopentane | - C22 H24 N2 O6 - | - C22 H24 N2 O6 - | - C44 H48 N4 O12 - | 2 | 1 | SK1180 | Baudoux, Guy; Norberg, Bernadette; Bousbaa, Jamal; Krief, Alain; Evrard, Guy | Dinitrobenzoate Derivative of a Chiral Arylcyclopentane | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1353 | 1355 | 10.1107/S0108270198004090 | 1.54178 | CuKα | 0.045 | 0.044 | null | null | null | 0.116 | null | null | null | null | null | 1.092 | null | null | has coordinates | Baudoux, Guy; Norberg, Bernadette; Bousbaa, Jamal; Krief, Alain; Evrard, Guy
Dinitrobenzoate Derivative of a Chiral Arylcyclopentane
Acta Crystallographica Section C
54(9)
(1998)
1353-1355 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007670.cif $
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2,007,671 | 6.184 | 0.002 | 17.787 | 0.004 | 11.746 | 0.002 | 90 | null | 91.65 | 0.02 | 90 | null | 1,291.5 | 0.6 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 2-O-benzoyl-myo-inositol-1,3,5-orthoformate | - C14 H14 O7 - | - C14 H14 O7 - | - C56 H56 O28 - | 4 | 1 | SX1052 | Samanta, Uttamkumar; Puranik, Vedavati G.; Chakrabarti, Pinak; Thoniyot, Praveen; Shashidhar, Mysore S. | 2-<i>O</i>-Benzoyl-<i>myo</i>-inositol-1,3,5-orthoformate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1289 | 1291 | 10.1107/S0108270197017721 | 0.71073 | MoKα | 0.0773 | 0.0679 | null | 0.2223 | 0.2115 | null | null | null | 1.082 | 1.153 | 1.153 | null | null | null | has coordinates | Samanta, Uttamkumar; Puranik, Vedavati G.; Chakrabarti, Pinak; Thoniyot, Praveen; Shashidhar, Mysore S.
2-<i>O</i>-Benzoyl-<i>myo</i>-inositol-1,3,5-orthoformate
Acta Crystallographica Section C
54(9)
(1998)
1289-1291 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007671.cif $
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2,007,672 | 15.638 | 0.003 | 8.65 | 0.002 | 15.778 | 0.002 | 90 | null | 98.503 | 0.014 | 90 | null | 2,110.8 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | 16α-Chloro-16β-cyano-3-methoxy-14,17α-ethenoestra-1,3,5(10)- trien-17β-yl Acetate | - C24 H26 Cl N O3 - | - C24 H26 Cl N O3 - | - C96 H104 Cl4 N4 O12 - | 4 | 2 | SX1056 | Bull, James R.; de Koning, Pieter D. | 16α-Chloro-16β-cyano-3-methoxy-14,17α-ethenoestra-1,3,5(10)-trien-17β-yl Acetate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1281 | 1282 | 10.1107/S0108270198000584 | 0.71069 | MoKα | 0.1568 | 0.064 | null | 0.161 | 0.151 | null | null | null | 0.972 | 1.299 | 1.299 | null | null | null | has coordinates | Bull, James R.; de Koning, Pieter D.
16α-Chloro-16β-cyano-3-methoxy-14,17α-ethenoestra-1,3,5(10)-trien-17β-yl Acetate
Acta Crystallographica Section C
54(9)
(1998)
1281-1282 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,007,673 | 17.9713 | 0.0012 | 5.6693 | 0.0009 | 13.9522 | 0.0011 | 90 | 0.001 | 126.87 | 0.0006 | 90 | 0.0011 | 1,137.2 | 0.2 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | ethylenediammonium bis(monohydrogenoxalate) monohydrate | - C6 H14 N2 O9 - | - C6 H14 N2 O9 - | - C24 H56 N8 O36 - | 4 | 0.5 | SX1061 | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R. | Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1347 | 1351 | 10.1107/S0108270198003734 | 0.71069 | MoKα | 0.0746 | 0.0447 | null | null | null | 0.1199 | null | null | null | null | null | 1.064 | null | null | has coordinates | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.
Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate
Acta Crystallographica Section C
54(9)
(1998)
1347-1351 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007673.cif $
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2,229,972 | 6.9718 | 0.0004 | 11.8902 | 0.0006 | 24.7024 | 0.0013 | 90 | null | 90 | null | 90 | null | 2,047.73 | 0.19 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P 21 21 21 | P 2ac 2ab | 19 | <i>catena</i>-Poly[[[[2-(2-pyridyl-κ<i>N</i>)-1<i>H</i>-benzimidazole- κ<i>N</i>^3^]copper(II)]-μ-L-methioninato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>'] perchlorate] | - C17 H19 Cl Cu N4 O6 S - | - C17 H19 Cl Cu N4 O6 S - | - C68 H76 Cl4 Cu4 N16 O24 S4 - | 4 | 1 | FF2004 | Lu, Yan-Mei; Le, Xue-Yi | <i>catena</i>-Poly[[[[2-(2-pyridyl-κ<i>N</i>)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]copper(II)]-μ-<small>L</small>-methioninato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>'] perchlorate] | Acta Crystallographica Section E | 2,011 | 67 | 5 | m642 | m643 | 10.1107/S1600536811014000 | 0.71073 | MoKα | 0.0599 | 0.0418 | null | null | 0.1026 | 0.1109 | null | null | null | null | null | 1.05 | null | null | has coordinates,has Fobs | Lu, Yan-Mei; Le, Xue-Yi
<i>catena</i>-Poly[[[[2-(2-pyridyl-κ<i>N</i>)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]copper(II)]-μ-<small>L</small>-methioninato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>'] perchlorate]
Acta Crystallographica Section E
67(5)
(2011)
m642-m643 | 176,789 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229972.cif $
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2,007,674 | 6.7954 | 0.0008 | 16.1594 | 0.0013 | 5.6307 | 0.001 | 90 | null | 90 | null | 90 | null | 618.3 | 0.14 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | P 21 21 2 | P 2 2ab | 18 | trimethylenediammonium bis(monohydrogenoxalate) monohydrate (β-form) | - C7 H16 N2 O9 - | - C7 H16 N2 O9 - | - C14 H32 N4 O18 - | 2 | 0.5 | SX1061 | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R. | Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1347 | 1351 | 10.1107/S0108270198003734 | 0.71073 | MoKα | 0.052 | 0.0356 | null | null | null | 0.1019 | null | null | null | null | null | 1.005 | null | null | has coordinates | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.
Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate
Acta Crystallographica Section C
54(9)
(1998)
1347-1351 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007674.cif $
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2,007,675 | 14.6727 | 0.0019 | 7.3876 | 0.0006 | 11.3348 | 0.0018 | 90 | null | 90 | null | 90 | null | 1,228.6 | 0.3 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | P c c n | -P 2ab 2ac | 56 | trimethylenediammonium bis(monohydrogenoxalate) monohydrate | - C7 H16 N2 O9 - | - C7 H16 N2 O9 - | - C28 H64 N8 O36 - | 4 | 0.5 | SX1061 | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R. | Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1347 | 1351 | 10.1107/S0108270198003734 | 0.71079 | MoKα | 0.0538 | 0.0367 | null | null | null | 0.108 | null | null | null | null | null | 0.982 | null | null | has coordinates | Barnes, John C.; Longhurst, Rayne W.; Weakley, Timothy J.R.
Ethylenediammonium Bis(monohydrogen oxalate) Monohydrate and Two Modifications of Trimethylenediammonium Bis(monohydrogen oxalate) Monohydrate
Acta Crystallographica Section C
54(9)
(1998)
1347-1351 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007675.cif $
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2,007,676 | 7.9808 | 0.0007 | 11.72 | 0.001 | 16.468 | 0.001 | 90 | null | 90 | null | 90 | null | 1,540.3 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | - C16 H15 Br N2 O3 - | - C16 H15 Br N2 O3 - | - C64 H60 Br4 N8 O12 - | 4 | 1 | TA1201 | White, Jonathan M.; Clark, Christopher I. | 2-(4-Bromo-2-nitrophenyl)-1-(4-dimethylaminophenyl)-1-ethanone | Acta Crystallographica Section C | 1,998 | 54 | 9 | 1304 | 1306 | 10.1107/S0108270198003989 | 1.5418 | CuKα | 0.0768 | 0.0482 | null | null | null | 0.1296 | null | null | null | null | null | 1.037 | null | null | has coordinates | White, Jonathan M.; Clark, Christopher I.
2-(4-Bromo-2-nitrophenyl)-1-(4-dimethylaminophenyl)-1-ethanone
Acta Crystallographica Section C
54(9)
(1998)
1304-1306 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,677 | 6.4274 | 0.001 | 11.826 | 0.002 | 17.616 | 0.002 | 90 | null | 90 | null | 90 | null | 1,339 | 0.3 | 122.4 | 0.5 | 122.4 | 0.5 | null | null | null | null | 4 | P n a m | -P 2c 2n | 62 | methylammonium hydrogen maleate | - C5 H9 N O4 - | - C5 H9 N O4 - | - C40 H72 N8 O32 - | 8 | 1 | AB1534 | Madsen, Dennis; Larsen, Sine | Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1507 | 1511 | 10.1107/S0108270198003606 | 0.71073 | MoKα | 0.074 | 0.05 | null | 0.075 | 0.072 | null | null | null | 2.203 | 2.439 | 2.439 | null | null | null | has coordinates | Madsen, Dennis; Larsen, Sine
Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion
Acta Crystallographica Section C
54(10)
(1998)
1507-1511 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
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2,018,058 | 13.128 | 0.003 | 9.493 | 0.003 | 15.412 | 0.004 | 90 | null | 113.57 | 0.03 | 90 | null | 1,760.5 | 0.9 | 100 | 2 | 100 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | Diammonium hexakis(thiocyanato-κ<i>N</i>)rhenate(IV) dimethyl sulfone tetrasolvate | - C14 H32 N8 O8 Re S10 - | - C14 H32 N8 O8 Re S10 - | - C28 H64 N16 O16 Re2 S20 - | 2 | 0.5 | FA3250 | Kochel, Andrzej; Hołyńska, Małgorzata | Diammonium hexakis(thiocyanato-κ<i>N</i>)rhenate(IV) dimethyl sulfone tetrasolvate | Acta Crystallographica Section C | 2,011 | 67 | 5 | m134 | m136 | 10.1107/S0108270111010535 | 0.71073 | MoKα | 0.0318 | 0.0233 | null | null | 0.0555 | 0.0571 | null | null | null | null | null | 1.004 | null | null | has coordinates | Kochel, Andrzej; Hołyńska, Małgorzata
Diammonium hexakis(thiocyanato-κ<i>N</i>)rhenate(IV) dimethyl sulfone tetrasolvate
Acta Crystallographica Section C
67(5)
(2011)
m134-m136 | 301,798 | 2025-08-19 | 6:44:10 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 09:12:48 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301798 $
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2,007,678 | 8.4738 | 0.0008 | 8.3444 | 0.0013 | 11.5727 | 0.001 | 90 | null | 98.729 | 0.008 | 90 | null | 808.81 | 0.16 | 122.4 | 0.5 | 122.4 | 0.5 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | dimethylammonium hydrogen maleate | - C6 H11 N O4 - | - C6 H11 N O4 - | - C24 H44 N4 O16 - | 4 | 1 | AB1534 | Madsen, Dennis; Larsen, Sine | Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1507 | 1511 | 10.1107/S0108270198003606 | 0.71073 | MoKα | 0.082 | 0.054 | null | 0.076 | 0.072 | null | null | null | 2.187 | 2.471 | 2.471 | null | null | null | has coordinates | Madsen, Dennis; Larsen, Sine
Methylamine and Dimethylamine Salts of the Hydrogen Maleate Ion
Acta Crystallographica Section C
54(10)
(1998)
1507-1511 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:08:28 +0300 (Fri, 13 Oct 2017) $
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007678.cif $
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2,007,679 | 12.617 | 0.0011 | 13.5333 | 0.0015 | 18.8645 | 0.0016 | 79.129 | 0.012 | 79.32 | 0.01 | 73.004 | 0.011 | 2,995.9 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C30 H42 Si3 - | - C30 H42 Si3 - | - C120 H168 Si12 - | 4 | 2 | AB1538 | Teng, Zhu; Stoeckli-Evans, Helen; Keese, Reinhart | A Tricyclic Trisiladiene | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1473 | 1475 | 10.1107/S0108270198004661 | 0.71073 | MoKα | 0.0797 | 0.0461 | null | null | null | 0.1291 | null | null | null | null | null | 0.86 | null | null | has coordinates | Teng, Zhu; Stoeckli-Evans, Helen; Keese, Reinhart
A Tricyclic Trisiladiene
Acta Crystallographica Section C
54(10)
(1998)
1473-1475 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,680 | 25.601 | 0.008 | 12.694 | 0.003 | 18.153 | 0.005 | 90 | null | 107.608 | 0.012 | 90 | null | 5,623 | 3 | 223 | 2 | 223 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Dekakis(acetato)bis(μ~4~-oxo)tetrakis(piridine) dimanganese(III)tetramanganese(II) pyridine solvate | - C45 H55 Mn6 N5 O22 - | - C44 H54 Mn6 N6 O22 - | - C176 H216 Mn24 N24 O88 - | 4 | 0.5 | AV1019 | Karsten, Peter; Strähle, Joachim | Deca-μ-acetato-di-μ~4~-oxo-tetra(pyridine-<i>N</i>)dimanganese(III)tetramanganese(II) Pyridine Solvate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1403 | 1406 | 10.1107/S0108270198005861 | 0.71073 | MoKα | 0.072 | 0.052 | null | 0.148 | null | 0.128 | null | null | 1.126 | null | null | 1.104 | null | null | has coordinates | Karsten, Peter; Strähle, Joachim
Deca-μ-acetato-di-μ~4~-oxo-tetra(pyridine-<i>N</i>)dimanganese(III)tetramanganese(II) Pyridine Solvate
Acta Crystallographica Section C
54(10)
(1998)
1403-1406 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
#$Revision: 198601 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007680.cif $
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2,007,681 | 7.2582 | 0.0014 | 9.585 | 0.002 | 15.47 | 0.003 | 93.626 | 0.012 | 101.703 | 0.011 | 101.479 | 0.01 | 1,026.8 | 0.4 | 223 | 2 | 223 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | trans-Bis(chloro)tetrakis(pyridine)iron(II) Di(1,8-diazabicyclo[5.4.0]undec-7-ene hydrochloride) | - C38 H54 Cl4 Fe N8 - | - C38 H54 Cl4 Fe N8 - | - C38 H54 Cl4 Fe N8 - | 1 | 0.5 | AV1020 | Karsten, Peter; Strähle, Joachim | Bis(1,8-diazabicyclo[5.4.0]undec-7-en-8-ium) <i>trans</i>-Dichlorotetra(pyridine-<i>N</i>)iron(II) Dichloride | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1406 | 1408 | 10.1107/S0108270198005873 | 1.5418 | CuKα | 0.06 | 0.054 | null | 0.161 | null | 0.154 | null | null | 1.117 | null | null | 1.128 | null | null | has coordinates | Karsten, Peter; Strähle, Joachim
Bis(1,8-diazabicyclo[5.4.0]undec-7-en-8-ium) <i>trans</i>-Dichlorotetra(pyridine-<i>N</i>)iron(II) Dichloride
Acta Crystallographica Section C
54(10)
(1998)
1406-1408 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
#$Revision: 198601 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007681.cif $
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2,007,682 | 6.585 | 0.001 | 11.066 | 0.002 | 14.207 | 0.003 | 90 | null | 101.45 | 0.03 | 90 | null | 1,014.7 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 2-Chloro-3-cyano-6-phenylpyridine | - C12 H7 Cl N2 - | - C12 H7 Cl N2 - | - C48 H28 Cl4 N8 - | 4 | 1 | AV1021 | Cyrañski, Michal K.; Mieczkowski, Jȯzef | 2-Chloro-3-cyano-6-phenylpyridine | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1521 | 1523 | 10.1107/S0108270198006015 | 1.54178 | CuKα | 0.064 | 0.05 | null | 0.163 | 0.132 | null | null | null | 1.032 | 1.077 | 1.077 | null | null | null | has coordinates | Cyrañski, Michal K.; Mieczkowski, Jȯzef
2-Chloro-3-cyano-6-phenylpyridine
Acta Crystallographica Section C
54(10)
(1998)
1521-1523 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007682.cif $
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2,007,683 | 10.326 | 0.001 | 8.67 | 0.001 | 10.72 | 0.001 | 90 | null | 94.93 | 0.01 | 90 | null | 956.17 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.058 | 0.023 | null | 0.0457 | 0.043 | null | null | null | 0.6 | 0.809 | 0.809 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007683.cif $
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2,007,684 | 10.314 | 0.001 | 8.587 | 0.001 | 10.71 | 0.001 | 90 | null | 94.95 | 0.01 | 90 | null | 945.01 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.0651 | 0.0269 | null | 0.0473 | 0.0441 | null | null | null | 0.759 | 0.959 | 0.959 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007684.cif $
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2,229,971 | 10.016 | 0.0002 | 11.3524 | 0.0002 | 14.248 | 0.0002 | 88.74 | 0.001 | 74.021 | 0.001 | 67.295 | 0.001 | 1,430.28 | 0.05 | 173 | 2 | 173 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | Tetraaquatetrakis{μ~2~-[1- (carboxylatomethyl)cyclohexyl]methanaminium}bis(μ~3~- hydroxido)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')tetrazinc(II) | - C36 H78 N10 O32 Zn4 - | - C36 H78 N10 O32 Zn4 - | - C36 H78 N10 O32 Zn4 - | 1 | 0.5 | EZ2233 | de Vries, Elise J. C.; Gamble, Caryn; Shaikjee, Ahmed | Tetraaquatetrakis{μ~2~-[1-(carboxylatomethyl)cyclohexyl]methanaminium}bis(μ~3~-hydroxido)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')tetrazinc(II) | Acta Crystallographica Section E | 2,011 | 67 | 5 | m573 | m574 | 10.1107/S1600536811011020 | 0.71073 | MoKα | 0.0539 | 0.047 | null | null | 0.1223 | 0.1278 | null | null | null | null | null | 1.046 | null | null | has coordinates,has disorder,has Fobs | de Vries, Elise J. C.; Gamble, Caryn; Shaikjee, Ahmed
Tetraaquatetrakis{μ~2~-[1-(carboxylatomethyl)cyclohexyl]methanaminium}bis(μ~3~-hydroxido)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')tetrazinc(II)
Acta Crystallographica Section E
67(5)
(2011)
m573-m574 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229971.cif $
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2,007,685 | 10.312 | 0.001 | 8.457 | 0.001 | 10.683 | 0.001 | 90 | null | 94.935 | 0.009 | 90 | null | 928.2 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.0638 | 0.0261 | null | 0.0498 | 0.046 | null | null | null | 0.785 | 0.973 | 0.973 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007685.cif $
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2,007,686 | 10.4 | 0.001 | 8.089 | 0.001 | 10.658 | 0.001 | 90 | null | 94.804 | 0.009 | 90 | null | 893.46 | 0.16 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.0528 | 0.0242 | null | 0.0458 | 0.0432 | null | null | null | 0.659 | 0.852 | 0.852 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,007,687 | 10.443 | 0.001 | 7.857 | 0.001 | 10.601 | 0.001 | 90 | null | 94.57 | 0.01 | 90 | null | 867.05 | 0.16 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.0517 | 0.025 | null | 0.049 | 0.0466 | null | null | null | 0.7 | 0.89 | 0.89 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
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2,007,688 | 10.457 | 0.001 | 7.619 | 0.001 | 10.477 | 0.001 | 90 | null | 94.126 | 0.01 | 90 | null | 832.56 | 0.16 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | nitropentaammine Co(III) chloride | - Cl2 Co H15 N6 O2 - | - Cl2 Co H15 N6 O2 - | - Cl8 Co4 H60 N24 O8 - | 4 | 0.5 | AV1022 | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali | Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1378 | 1383 | 10.1107/S0108270198004879 | 0.71073 | MoKα | 0.0468 | 0.0242 | null | 0.0486 | 0.0467 | null | null | null | 0.71 | 0.881 | 0.881 | null | null | null | has coordinates | Boldyreva, Elena V.; Ahsbahs, Hans; Naumov, Dmitry Yu.; Kutoglu, Ali
Pentaamminenitrocobalt(III) Dichloride at Pressures of 0.24, 0.52, 1.25, 1.91 and 3.38 GPa
Acta Crystallographica Section C
54(10)
(1998)
1378-1383 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,007,689 | 12.03 | 0.002 | 13.652 | 0.003 | 15.462 | 0.003 | 87.91 | 0.03 | 77.62 | 0.03 | 72.56 | 0.03 | 2,365.3 | 0.9 | 160 | null | 160 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C46 H30 Fe3 N8 Ni2 S8 - | - C46 H30 Fe3 N8 Ni2 S8 - | - C92 H60 Fe6 N16 Ni4 S16 - | 2 | 1 | BK1370 | Day, Michael W.; Qin, Jingui; Yang, Chuluo | Ferrocene, Ferrocenium and a Bis(maleonitriledithiolate) Complex of Nickel | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1413 | 1416 | 10.1107/S0108270198002340 | 0.71073 | MoKα | 0.049 | 0.035 | null | 0.069 | null | 0.064 | null | null | 1.44 | null | null | 1.5 | null | null | has coordinates | Day, Michael W.; Qin, Jingui; Yang, Chuluo
Ferrocene, Ferrocenium and a Bis(maleonitriledithiolate) Complex of Nickel
Acta Crystallographica Section C
54(10)
(1998)
1413-1416 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
#$Revision: 198601 $
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2,018,057 | 11.298 | 0.002 | 11.346 | 0.002 | 18.391 | 0.003 | 101.66 | 0.01 | 93.46 | 0.01 | 115.55 | 0.01 | 2,053.8 | 0.7 | 200 | 2 | 200 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | di-μ-iodido-1:1'κ^4^<i>I</i>-bis[tri-μ~3~-imido-1:2:3κ^3^<i>N</i>; 1:2:4κ^3^<i>N</i>;1:3:4κ^3^<i>N</i>-μ~3~-nitrido-2:3:4κ^3^<i>N</i>- tris[2,3,4(η^5^)-pentamethylcyclopentadienyl](pyridine-1κ<i>N</i>)- <i>tetrahedro</i>-potassiumtrititanium(IV)] | - C70 H106 I2 K2 N10 Ti6 - | - C70 H106 I2 K2 N10 Ti6 - | - C70 H106 I2 K2 N10 Ti6 - | 1 | 0.5 | DT3001 | Martín, Avelino; Mena, Miguel; Pérez-Redondo, Adrián; Yélamos, Carlos | A new double-cube nitride complex containing titanium and potassium | Acta Crystallographica Section C | 2,011 | 67 | 5 | m157 | m159 | 10.1107/S0108270111012686 | 0.71073 | MoKα | 0.0895 | 0.047 | null | null | 0.1053 | 0.1192 | null | null | null | null | null | 0.983 | null | null | has coordinates,has Fobs | Martín, Avelino; Mena, Miguel; Pérez-Redondo, Adrián; Yélamos, Carlos
A new double-cube nitride complex containing titanium and potassium
Acta Crystallographica Section C
67(5)
(2011)
m157-m159 | 176,760 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
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2,007,690 | 10.4968 | 0.0009 | 13.5 | 0.001 | 15.626 | 0.001 | 90 | null | 96.986 | 0.006 | 90 | null | 2,197.9 | 0.3 | 294 | null | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C24 H18 Cl N O6 S - | - C24 H18 Cl N O6 S - | - C96 H72 Cl4 N4 O24 S4 - | 4 | 1 | BK1376 | Nancy N. Tsou; Richard G. Ball; Patrick J. Roy; Yves Leblanc | 4-Chloro-2-{4-[<i>p</i>-(methylsulfonyl)phenyl]-2-oxo-5-phenyl-2,3-dihydro-1,3-oxazol-3-yl}phenyl Acetate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1493 | 1494 | 10.1107/S0108270198003928 | 1.54184 | CuKα | null | 0.049 | null | null | 0.128 | null | null | null | null | 1.026 | 1.026 | null | null | null | has coordinates | Nancy N. Tsou; Richard G. Ball; Patrick J. Roy; Yves Leblanc
4-Chloro-2-{4-[<i>p</i>-(methylsulfonyl)phenyl]-2-oxo-5-phenyl-2,3-dihydro-1,3-oxazol-3-yl}phenyl Acetate
Acta Crystallographica Section C
54(10)
(1998)
1493-1494 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,691 | 11.5036 | 0.0006 | 12.8861 | 0.0006 | 14.8388 | 0.0009 | 102.351 | 0.004 | 98.342 | 0.005 | 103.493 | 0.004 | 2,044.9 | 0.2 | 297 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | pyridine [2-{1-methoxy-2-acetyl-2-(ethoxycarbonyl)} ethyl-8-quinolinol-C,N, O] palladium(II) | - C22 H22 N2 O5 Pd - | - C22 H22 N2 O5 Pd - | - C88 H88 N8 O20 Pd4 - | 4 | 2 | BK1380 | Billodeaux, Damon R.; Fronczek, Frank R.; Yoneda, Akio; Newkome, George R. | [2-(2-Acetyl-2-ethoxycarbonyl-1-methoxyethyl)-8-quinolinolato-<i>C</i>,<i>N</i>,<i>O</i>](pyridine-<i>N</i>)palladium(II) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1439 | 1441 | 10.1107/S0108270198005538 | 0.71073 | MoKα | null | 0.045 | null | null | 0.048 | null | null | null | null | 2.26 | 2.26 | null | null | null | has coordinates | Billodeaux, Damon R.; Fronczek, Frank R.; Yoneda, Akio; Newkome, George R.
[2-(2-Acetyl-2-ethoxycarbonyl-1-methoxyethyl)-8-quinolinolato-<i>C</i>,<i>N</i>,<i>O</i>](pyridine-<i>N</i>)palladium(II)
Acta Crystallographica Section C
54(10)
(1998)
1439-1441 | 208,360 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-06-14 04:32:00 +0300 (Thu, 14 Jun 2018) $
#$Revision: 208360 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007691.cif $
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2,007,692 | 14.489 | 0.0002 | 14.489 | 0.0002 | 21.5432 | 0.0003 | 90 | null | 90 | null | 90 | null | 4,522.59 | 0.11 | 295 | null | 295 | null | null | null | null | null | 5 | P 42/n :2 | -P 4bc | 86 | octakis-tetramethylammonium acetate,docosavanadate hydrate | - C34 H107.5 N8 O60.25 V22 - | - C34 H48 N8 O60.26 V22 - | - C68 H96 N16 O120.52 V44 - | 2 | 0.25 | BK1386 | Chirayil, Thomas; Zavalij, Peter Y.; Whittingham, M. Stanley | The Inserting Host‒Guest System in [N(CH~3~)~4~]~8~[(CH~3~COO)V~22~O~54~].4.25H~2~O | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1441 | 1444 | 10.1107/S0108270198006404 | 0.71073 | MoKα | null | 0.052 | null | null | 0.076 | null | null | null | null | 1.53 | 1.53 | null | null | null | has coordinates | Chirayil, Thomas; Zavalij, Peter Y.; Whittingham, M. Stanley
The Inserting Host‒Guest System in [N(CH~3~)~4~]~8~[(CH~3~COO)V~22~O~54~].4.25H~2~O
Acta Crystallographica Section C
54(10)
(1998)
1441-1444 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
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2,007,693 | 11.479 | 0.002 | 12.828 | 0.002 | 22.475 | 0.003 | 89.04 | 0.01 | 84.8 | 0.01 | 69.19 | 0.01 | 3,080.4 | 0.9 | 153 | 2 | 153.2 | null | null | null | null | null | 8 | P -1 | -P 1 | 2 | - C49 H78 Cl2 F12 N6 O14 P2 Ru - | - C49 H78 Cl2 F12 N6 O14 P2 Ru - | - C98 H156 Cl4 F24 N12 O28 P4 Ru2 - | 2 | 1 | BK1387 | Dong I. Yoon; Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern | An Adduct Between Tetraammine(1,10-phenanthroline)ruthenium(II) and Dibenzo-42-crown-14 | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1427 | 1431 | 10.1107/S010827019800554X | 0.7107 | MoKα | 0.068 | 0.047 | null | 0.081 | 0.073 | null | null | null | 1.292 | 1.89 | 1.89 | null | null | null | has coordinates | Dong I. Yoon; Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern
An Adduct Between Tetraammine(1,10-phenanthroline)ruthenium(II) and Dibenzo-42-crown-14
Acta Crystallographica Section C
54(10)
(1998)
1427-1431 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,229,970 | 8.305 | 0.0008 | 13.339 | 0.001 | 9.9948 | 0.0009 | 90 | null | 97.876 | 0.009 | 90 | null | 1,096.78 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | <i>N</i>-(2-Methylphenylsulfonyl)propanamide | - C10 H13 N O3 S - | - C10 H13 N O3 S - | - C40 H52 N4 O12 S4 - | 4 | 1 | DS2108 | Shakuntala, K.; Foro, Sabine; Gowda, B. Thimme | <i>N</i>-(2-Methylphenylsulfonyl)propanamide | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1187 | 10.1107/S1600536811014164 | 0.71073 | MoKα | 0.071 | 0.0435 | null | null | 0.0949 | 0.1076 | null | null | null | null | null | 1.043 | null | null | has coordinates,has Fobs | Shakuntala, K.; Foro, Sabine; Gowda, B. Thimme
<i>N</i>-(2-Methylphenylsulfonyl)propanamide
Acta Crystallographica Section E
67(5)
(2011)
o1187 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
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2,007,694 | 9.004 | 0.002 | 7.065 | 0.002 | 9.851 | 0.003 | 90 | null | 97.96 | 0.02 | 90 | null | 620.6 | 0.3 | 295 | 2 | 295 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 4-hydroxymethyl-4-methyl-2-oxazolidinone | - C5 H9 N O3 - | - C5 H9 N O3 - | - C20 H36 N4 O12 - | 4 | 1 | BK1395 | Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D. | Two Oxazolidinone Derivatives | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1529 | 1532 | 10.1107/S0108270198005654 | 0.71073 | MoKα | 0.073 | 0.045 | null | 0.122 | 0.106 | null | null | null | 1.058 | 1.119 | 1.119 | null | null | null | has coordinates | Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D.
Two Oxazolidinone Derivatives
Acta Crystallographica Section C
54(10)
(1998)
1529-1532 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007694.cif $
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2,007,695 | 10.45 | 0.003 | 8.198 | 0.003 | 17.497 | 0.007 | 90 | null | 106.85 | 0.03 | 90 | null | 1,434.6 | 0.9 | 294 | 2 | 294 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | 4-ethyl-4-hydroxymethyl-2-oxazolidinone | - C6 H11 N O3 - | - C6 H11 N O3 - | - C48 H88 N8 O24 - | 8 | 1 | BK1395 | Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D. | Two Oxazolidinone Derivatives | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1529 | 1532 | 10.1107/S0108270198005654 | 0.71073 | MoKα | 0.046 | 0.037 | null | 0.103 | 0.096 | null | null | null | 1.081 | 1.107 | 1.107 | null | null | null | has coordinates | Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Fleury, Jennifer R.; Maddox, Spencer D.
Two Oxazolidinone Derivatives
Acta Crystallographica Section C
54(10)
(1998)
1529-1532 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,007,696 | 12.544 | 0.001 | 9.017 | 0.002 | 15.12 | 0.001 | 90 | null | 110.54 | 0.01 | 90 | null | 1,601.5 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 1,2-di-η^5^-cyclopentadienyl-1,2-dinickela-closo-dodecaborane | - C10 H20 B10 Ni2 - | - C10 H20 B10 Ni2 - | - C40 H80 B40 Ni8 - | 4 | 1 | BM1225 | Jian-Min Dou; Chun-Hua Hu; Jian-Ming Gu; Yong Nie; Hai-Jun Yao; Ruo-Shui Jin; Pei-Ju Zheng | A <i>closo</i>-12-Vertex Dinickelaborane: [(η^5^-C~5~H~5~)~2~Ni~2~B~10~H~10~] | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1418 | 1419 | 10.1107/S0108270198004077 | 0.71073 | MoKα | null | 0.0343 | null | null | null | 0.0989 | null | null | null | null | null | 1.1 | null | null | has coordinates | Jian-Min Dou; Chun-Hua Hu; Jian-Ming Gu; Yong Nie; Hai-Jun Yao; Ruo-Shui Jin; Pei-Ju Zheng
A <i>closo</i>-12-Vertex Dinickelaborane: [(η^5^-C~5~H~5~)~2~Ni~2~B~10~H~10~]
Acta Crystallographica Section C
54(10)
(1998)
1418-1419 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007696.cif $
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2,229,969 | 18.8185 | 0.0006 | 5.7911 | 0.0002 | 19.3911 | 0.0007 | 90 | null | 103.338 | 0.001 | 90 | null | 2,056.24 | 0.12 | 200 | 2 | 200 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | <i>N</i>-Benzylaniline | <i>N</i>-Benzylaniline | - C13 H13 N - | - C13 H13 N - | - C104 H104 N8 - | 8 | 2 | DS2106 | Betz, Richard; McCleland, Cedric; Marchand, Harold | <i>N</i>-Benzylaniline | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1195 | 10.1107/S1600536811014553 | 0.71073 | MoKα | 0.054 | 0.044 | null | null | 0.1096 | 0.1182 | null | null | null | null | null | 1.037 | null | null | has coordinates,has Fobs | Betz, Richard; McCleland, Cedric; Marchand, Harold
<i>N</i>-Benzylaniline
Acta Crystallographica Section E
67(5)
(2011)
o1195 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229969.cif $
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2,007,697 | 9.735 | 0.003 | 12.7753 | 0.0008 | 9.735 | 0.003 | 90 | null | 110.58 | 0.002 | 90 | null | 1,133.5 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 2-crotonoyl-5,8-dihydro-1-naphthol | - C14 H14 O2 - | - C14 H14 O2 - | - C56 H56 O8 - | 4 | 1 | BM1234 | Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T. | 2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1496 | 1499 | 10.1107/S0108270198005599 | 0.71073 | MoKα | 0.072 | 0.051 | null | 0.134 | 0.118 | null | null | null | 1.096 | 1.128 | 1.128 | null | null | null | has coordinates | Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.
2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II)
Acta Crystallographica Section C
54(10)
(1998)
1496-1499 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007697.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,698 | 12.2964 | 0.0002 | 16.2109 | 0.0003 | 7.8517 | 0.0002 | 90 | null | 103.197 | 0.002 | 90 | null | 1,523.79 | 0.06 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 4-(1-naphthoyl)-5,8-dihydro-1-naphthol | - C21 H16 O2 - | - C21 H16 O2 - | - C84 H64 O8 - | 4 | 1 | BM1234 | Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan | 2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1496 | 1499 | 10.1107/S0108270198005599 | 0.71073 | MoKα | 0.149 | 0.059 | null | 0.134 | 0.101 | null | null | null | 1.005 | 1.172 | 1.172 | null | null | null | has coordinates | Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan
2-Crotonoyl-5,8-dihydro-1-naphthol, (I), and 4-(1-Naphthoyl)-5,8-dihydro-1-naphthol, (II)
Acta Crystallographica Section C
54(10)
(1998)
1496-1499 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007698.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,699 | 14.131 | 0.003 | 8.281 | 0.002 | 15.473 | 0.003 | 90 | null | 108.36 | 0.02 | 90 | null | 1,718.5 | 0.7 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | (1RS,10aRS)-3-Imino-1-(2-thienyl)-1,2,3,9,10,10a-hexahydrophenanthrene-2,2,4- tricarbonitrile | - C21 H14 N4 S - | - C21 H14 N4 S - | - C84 H56 N16 S4 - | 4 | 1 | BM1245 | Elgemeie, Galal E. H.; Farag, Dalia S.; Jones, Peter G. | (1<i>RS</i>,10a<i>RS</i>)-3-Imino-1-(2-thienyl)-1,2,3,9,10,10a-hexahydrophenanthrene-2,2,4-tricarbonitrile | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1466 | 1468 | 10.1107/S0108270198005022 | 0.71073 | MoKα | 0.108 | 0.043 | null | 0.078 | 0.065 | null | null | null | 0.791 | 0.979 | 0.979 | null | null | null | has coordinates,has disorder,has Fobs | Elgemeie, Galal E. H.; Farag, Dalia S.; Jones, Peter G.
(1<i>RS</i>,10a<i>RS</i>)-3-Imino-1-(2-thienyl)-1,2,3,9,10,10a-hexahydrophenanthrene-2,2,4-tricarbonitrile
Acta Crystallographica Section C
54(10)
(1998)
1466-1468 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/76/2007699.cif $
#-------------------------------------------------------------------... | ||||||||||
7,106,497 | 4.9845 | 0.0009 | 9.456 | 0.002 | 18.431 | 0.005 | 90 | null | 90.803 | 0.015 | 90 | null | 868.6 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C6 H4 Cu2 N2 O7 - | - C6 H Cu2 N2 O7 - | - C24 H4 Cu8 N8 O28 - | 4 | 1 | Chao Chen; Jian-Ke Sun; Wei Li; Chang-Neng Chen; Jie Zhang | Structural interconversion between a chain polymer and a two-dimensional network accompanied by tunable magnetic properties | Chem.Commun. | 2,011 | null | 6683 | 10.1039/c0cc05763k | 0.71073 | MoKα | 0.0618 | 0.0475 | null | null | 0.1643 | 0.2311 | null | null | null | null | null | 1.109 | null | null | has coordinates | Chao Chen; Jian-Ke Sun; Wei Li; Chang-Neng Chen; Jie Zhang
Structural interconversion between a chain polymer and a two-dimensional network accompanied by tunable magnetic properties
Chem.Commun.
(2011)
6683 | 180,168 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 03:05:44 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180168 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/10/64/7106497.cif $
#-------------------------------------------------------------------... | ||||||||||||||
2,007,700 | 11.017 | 0.003 | 11.511 | 0.003 | 14.292 | 0.003 | 100.61 | 0.02 | 103.52 | 0.02 | 117.69 | 0.02 | 1,467.4 | 0.8 | 178 | 2 | 178 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | trans-1,3-Diethoxy-5,5-dimethyl-1,3-diphospha-5-silacyclohexane-1,3-dione | - C9 H22 O4 P2 Si - | - C9 H22 O4 P2 Si - | - C36 H88 O16 P8 Si4 - | 4 | 2 | BM1247 | Jones, Peter G.; Weinkauf, Andreas | <i>trans</i>-1,3-Diethoxy-5,5-dimethyl-1,3-diphospha-5-silacyclohexane-1,3-dione | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1449 | 1451 | 10.1107/S0108270198006337 | 0.71073 | MoKα | 0.039 | 0.032 | null | 0.089 | 0.084 | null | null | null | 1.044 | 1.059 | 1.059 | null | null | null | has coordinates,has disorder | Jones, Peter G.; Weinkauf, Andreas
<i>trans</i>-1,3-Diethoxy-5,5-dimethyl-1,3-diphospha-5-silacyclohexane-1,3-dione
Acta Crystallographica Section C
54(10)
(1998)
1449-1451 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007700.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,701 | 7.313 | 0.002 | 9.028 | 0.002 | 18.61 | 0.005 | 90 | null | 97.34 | 0.02 | 90 | null | 1,218.6 | 0.5 | 178 | 2 | 178 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | cis-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione | - C8 H18 O4 P2 - | - C8 H18 O4 P2 - | - C32 H72 O16 P8 - | 4 | 1 | BM1249 | Jones, Peter G.; Fischer, Axel K. | <i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1451 | 1453 | 10.1107/S0108270198006349 | 0.71073 | MoKα | 0.058 | 0.04 | null | 0.121 | 0.103 | null | null | null | 1.032 | 1.013 | 1.013 | null | null | null | has coordinates | Jones, Peter G.; Fischer, Axel K.
<i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione
Acta Crystallographica Section C
54(10)
(1998)
1451-1453 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007701.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,702 | 7.431 | 0.002 | 18.715 | 0.005 | 17.183 | 0.006 | 90 | null | 99.06 | 0.03 | 90 | null | 2,359.8 | 1.2 | 178 | 2 | 178 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | trans-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione | - C8 H18 O4 P2 - | - C8 H18 O4 P2 - | - C64 H144 O32 P16 - | 8 | 2 | BM1249 | Jones, Peter G.; Fischer, Axel K. | <i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1451 | 1453 | 10.1107/S0108270198006349 | 0.71073 | MoKα | 0.059 | 0.038 | null | 0.105 | 0.09 | null | null | null | 1.053 | 1.046 | 1.046 | null | null | null | has coordinates,has disorder | Jones, Peter G.; Fischer, Axel K.
<i>cis</i>- and <i>trans</i>-1,3-Diethoxy-1,3-diphosphorinane-1,3-dione
Acta Crystallographica Section C
54(10)
(1998)
1451-1453 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007702.cif $
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2,007,703 | 25.108 | 0.01 | 10.954 | 0.005 | 8.547 | 0.004 | 90 | null | 94.82 | 0.04 | 90 | null | 2,342.4 | 1.8 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | cis-3,5-Diethoxy-3,5-dioxo-1-oxa-3,5-diphosphorinane | - C7 H16 O5 P2 - | - C7 H16 O5 P2 - | - C56 H128 O40 P16 - | 8 | 1 | BM1250 | Jones, Peter G.; Weinkauf, Andreas | <i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1453 | 1456 | 10.1107/S0108270198006155 | 0.71073 | MoKα | 0.047 | 0.036 | null | 0.105 | 0.096 | null | null | null | 1.031 | 1.052 | 1.052 | null | null | null | has coordinates | Jones, Peter G.; Weinkauf, Andreas
<i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione
Acta Crystallographica Section C
54(10)
(1998)
1453-1456 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007703.cif $
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2,007,704 | 9.058 | 0.002 | 15.312 | 0.003 | 8.27 | 0.002 | 90 | null | 90 | null | 90 | null | 1,147 | 0.4 | 178 | 2 | 178 | 2 | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | trans-3,5-Diethoxy-3,5-dioxo-1-oxa-3,5-diphosphorinane | - C7 H16 O5 P2 - | - C7 H16 O5 P2 - | - C28 H64 O20 P8 - | 4 | 1 | BM1250 | Jones, Peter G.; Weinkauf, Andreas | <i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1453 | 1456 | 10.1107/S0108270198006155 | 0.71073 | MoKα | 0.036 | 0.03 | null | 0.08 | 0.076 | null | null | null | 1.027 | 1.033 | 1.033 | null | null | null | has coordinates | Jones, Peter G.; Weinkauf, Andreas
<i>cis</i>- and <i>trans</i>-3,5-Diethoxy-1-oxa-3,5-diphosphorinane-3,5-dione
Acta Crystallographica Section C
54(10)
(1998)
1453-1456 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007704.cif $
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2,007,705 | 9.887 | 0.002 | 12.666 | 0.003 | 20.345 | 0.004 | 90 | null | 102.78 | 0.02 | 90 | null | 2,484.7 | 0.9 | 178 | 2 | 178 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | {Difluoromethane-bis(diisopropylphosphonite)}tetracarbonylmolybdenum(0) | - C17 H28 F2 Mo O8 P2 - | - C17 H28 F2 Mo O8 P2 - | - C68 H112 F8 Mo4 O32 P8 - | 4 | 1 | BM1251 | Jones, Peter G. | Tetracarbonyl[difluoromethylenebis(diisopropoxyphosphine-<i>P</i>)]molybdenum(0) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1447 | 1448 | 10.1107/S0108270198005885 | 0.71073 | MoKα | 0.038 | 0.027 | null | null | null | 0.072 | null | null | null | null | null | 1.029 | null | null | has coordinates | Jones, Peter G.
Tetracarbonyl[difluoromethylenebis(diisopropoxyphosphine-<i>P</i>)]molybdenum(0)
Acta Crystallographica Section C
54(10)
(1998)
1447-1448 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007705.cif $
#-------------------------------------------------------------------... | ||||||||||
7,106,496 | 6.9264 | 0.0011 | 18.236 | 0.003 | 10.118 | 0.0015 | 90 | null | 96.601 | 0.012 | 90 | null | 1,269.5 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C6 H12 Cu2 N2 O11 - | - C6 H2 Cu2 N2 O11 - | - C24 H8 Cu8 N8 O44 - | 4 | 1 | Chao Chen; Jian-Ke Sun; Wei Li; Chang-Neng Chen; Jie Zhang | Structural interconversion between a chain polymer and a two-dimensional network accompanied by tunable magnetic properties | Chem.Commun. | 2,011 | null | 6683 | 10.1039/c0cc05763k | 0.71073 | MoKα | 0.0673 | 0.0463 | null | null | 0.1078 | 0.1203 | null | null | null | null | null | 1.07 | null | null | has coordinates | Chao Chen; Jian-Ke Sun; Wei Li; Chang-Neng Chen; Jie Zhang
Structural interconversion between a chain polymer and a two-dimensional network accompanied by tunable magnetic properties
Chem.Commun.
(2011)
6683 | 180,168 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-26 03:05:44 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180168 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/10/64/7106496.cif $
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2,007,706 | 13.756 | 0.002 | 8.9663 | 0.0014 | 11.6831 | 0.0018 | 90 | null | 99.828 | 0.01 | 90 | null | 1,419.9 | 0.4 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | 3,3'-[Ethanediylbis(aminomethylene)]bis(pentane-2,4-dione) | - C14 H20 N2 O4 - | - C14 H20 N2 O4 - | - C56 H80 N8 O16 - | 4 | 0.5 | BM1271 | König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G. | 3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1468 | 1471 | 10.1107/S0108270198009263 | 0.71073 | MoKα | 0.066 | 0.04 | null | 0.093 | 0.087 | null | null | null | 0.909 | 1.047 | 1.047 | null | null | null | has coordinates | König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G.
3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product
Acta Crystallographica Section C
54(10)
(1998)
1468-1471 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007706.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,707 | 8.542 | 0.003 | 9.406 | 0.003 | 30.213 | 0.008 | 90 | null | 90 | null | 90 | null | 2,427.5 | 1.3 | 173 | 2 | 173 | 2 | null | null | null | null | 7 | P c a 21 | P 2c -2ac | 29 | [{6,13-diacetyl-5,12-dimethyl-1,4,8,11-tetraazacyclotetradeca- 4,6,11,13-tetraenato(2-)}nickel(II)] deuterochloroform solvate (1:2) | - C18 H22 Cl6 D2 N4 Ni O2 - | - C18 H24 Cl6 N4 Ni O2 - | - C72 H96 Cl24 N16 Ni4 O8 - | 4 | 1 | BM1271 | König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G. | 3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1468 | 1471 | 10.1107/S0108270198009263 | 0.71073 | MoKα | 0.036 | 0.031 | null | null | null | 0.069 | null | null | null | null | null | 1.055 | null | null | has coordinates | König, Burkhard; Pelka, Mario; Dix, Ina; Jones, Peter G.
3,3'-[Ethane-1,2-diylbis(aminomethylene)]bis(pentane-2,4-dione) and the Nickel(II) Complex of a Condensation Product
Acta Crystallographica Section C
54(10)
(1998)
1468-1471 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007707.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,708 | 12.414 | 0.003 | 11.891 | 0.003 | 9.062 | 0.002 | 90 | null | 94.23 | 0.02 | 90 | null | 1,334 | 0.6 | 143 | 2 | 143 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | 1,2;4,5-Di-O-isopropylidene-galactitol | - C12 H22 O6 - | - C12 H22 O6 - | - C48 H88 O24 - | 4 | 1 | BM1272 | König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G. | 1,2:4,5-Di-<i>O</i>-isopropylidenegalactitol | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1471 | 1473 | 10.1107/S0108270198009275 | 0.71073 | MoKα | 0.106 | 0.058 | null | null | null | 0.118 | null | null | null | null | null | 1.063 | null | null | has coordinates | König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.
1,2:4,5-Di-<i>O</i>-isopropylidenegalactitol
Acta Crystallographica Section C
54(10)
(1998)
1471-1473 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007708.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,709 | 7.664 | 0.002 | 7.664 | 0.002 | 10.241 | 0.002 | 90 | null | 90 | null | 90 | null | 601.5 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 42/m n m | -P 4n 2n | 136 | Disodium Europium Zinc Diphosphate | Disodium Europium Zinc Diphosphate | - Eu0.02 Na1.94 O7 P2 Zn - | - Eu0.017 Na1.948 O7 P2 Zn - | - Eu0.068 Na7.792 O28 P8 Zn4 - | 4 | 0.25 | BR1194 | Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M. | Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1373 | 1376 | 10.1107/S0108270198006246 | 0.71073 | MoKα | 0.083 | 0.059 | null | null | 0.137 | 0.137 | null | null | null | 1.229 | 1.229 | 1.229 | null | null | has coordinates,has Fobs | Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M.
Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate
Acta Crystallographica Section C
54(10)
(1998)
1373-1376 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007709.cif $
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2,007,710 | 7.656 | 0.001 | 7.656 | 0.001 | 10.233 | 0.002 | 90 | null | 90 | null | 90 | null | 599.8 | 0.16 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 42/m n m | -P 4n 2n | 136 | Disodium Zinc Diphosphate | Disodium Zinc Diphosphate | - Na2 O7 P2 Zn - | - Na2 O7 P2 Zn - | - Na8 O28 P8 Zn4 - | 4 | 0.25 | BR1194 | Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M. | Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1373 | 1376 | 10.1107/S0108270198006246 | 0.71073 | MoKα | 0.052 | 0.039 | null | null | 0.102 | 0.102 | null | null | null | 1.113 | 1.113 | 1.113 | null | null | has coordinates,has Fobs | Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M.
Disodium Zinc Pyrophosphate and Disodium (Europium) Zinc Pyrophosphate
Acta Crystallographica Section C
54(10)
(1998)
1373-1376 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007710.cif $
#-------------------------------------------------------------------... | |||||||||
2,229,968 | 8.1389 | 0.0003 | 12.8748 | 0.0004 | 21.5528 | 0.0008 | 90 | null | 90 | null | 90 | null | 2,258.45 | 0.14 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | 1,3-Dibenzyl-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione | - C29 H20 N2 O3 - | - C29 H20 N2 O3 - | - C116 H80 N8 O12 - | 4 | 1 | DN2679 | Afrakssou, Zahra; Kandri Rodi, Youssef; Capet, Frédéric; Essassi, El Mokhtar; El Ammari, Lahcen | 1,3-Dibenzyl-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1253 | o1254 | 10.1107/S1600536811015078 | 0.71073 | MoKα | 0.0541 | 0.0394 | null | null | 0.0981 | 0.1084 | null | null | null | null | null | 1.051 | null | null | has coordinates,has Fobs | Afrakssou, Zahra; Kandri Rodi, Youssef; Capet, Frédéric; Essassi, El Mokhtar; El Ammari, Lahcen
1,3-Dibenzyl-1<i>H</i>-anthra[1,2-<i>d</i>]imidazole-2,6,11(3<i>H</i>)-trione
Acta Crystallographica Section E
67(5)
(2011)
o1253-o1254 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229968.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,711 | 13.196 | 0.002 | 13.196 | 0.002 | 7.943 | 0.003 | 90 | null | 90 | null | 120 | null | 1,197.8 | 0.5 | 183 | null | 183 | null | null | null | null | null | 3 | P -6 2 c | P -6c -2c | 190 | Potassium pentasilver trisulfide | - Ag5 K S3 - | - Ag5 K S3 - | - Ag30 K6 S18 - | 6 | 0.5 | BR1202 | Emirdag, Mehtap; Schimek, George L.; Kolis, Joseph W. | KAg~5~S~3~ | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1376 | 1378 | 10.1107/S0108270198003680 | 0.71073 | MoKα | 0.084 | 0.062 | null | 0.069 | 0.04 | null | null | null | null | 2.71 | 2.71 | null | null | null | has coordinates | Emirdag, Mehtap; Schimek, George L.; Kolis, Joseph W.
KAg~5~S~3~
Acta Crystallographica Section C
54(10)
(1998)
1376-1378 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007711.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,712 | 9.617 | 0.002 | 10.209 | 0.002 | 12.721 | 0.003 | 90 | null | 110.55 | 0.03 | 90 | null | 1,169.5 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 1,4-Benzenediamine N-[(3-nitrophenyl)methylene] | - C13 H11 N3 O2 - | - C13 H11 N3 O2 - | - C52 H44 N12 O8 - | 4 | 1 | CF1208 | Yang, Qing-chuan; Tang, You-qi; Yang, Wen-jun; Chen, Hui-ying | <i>N</i>-(3-Nitrobenzylidene)-<i>p</i>-phenylenediamine | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1532 | 1534 | 10.1107/S0108270198004818 | 0.71073 | MoKα | 0.101 | 0.052 | null | null | null | 0.159 | null | null | null | null | null | 1.088 | null | null | has coordinates | Yang, Qing-chuan; Tang, You-qi; Yang, Wen-jun; Chen, Hui-ying
<i>N</i>-(3-Nitrobenzylidene)-<i>p</i>-phenylenediamine
Acta Crystallographica Section C
54(10)
(1998)
1532-1534 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007712.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,713 | 13.002 | 0.009 | 9.329 | 0.006 | 22.798 | 0.014 | 90 | null | 95.21 | 0.05 | 90 | null | 2,754 | 3 | 298 | 2 | 298 | 2 | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | 15 | 1,2,5,6,dibenzofluorenone | 13-H-Dibenzo[a,g]fluoren-13-one | - C21 H12 O - | - C21 H12 O - | - C168 H96 O8 - | 8 | 1 | CF1248 | Morris, David G.; Ryder, Karl S.; Howie, R. Alan | 13<i>H</i>-Dibenzo[<i>a</i>,<i>g</i>]fluoren-13-one | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1542 | 1544 | 10.1107/S0108270198006167 | 0.71073 | MoKα | 0.101 | 0.052 | null | null | null | 0.136 | null | null | null | null | null | 1.01 | null | null | has coordinates,has Fobs | Morris, David G.; Ryder, Karl S.; Howie, R. Alan
13<i>H</i>-Dibenzo[<i>a</i>,<i>g</i>]fluoren-13-one
Acta Crystallographica Section C
54(10)
(1998)
1542-1544 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007713.cif $
#-------------------------------------------------------------------... | |||||||||
2,007,714 | 11.4712 | 0.0008 | 12.3457 | 0.0008 | 20.582 | 0.002 | 90 | null | 90 | null | 90 | null | 2,914.8 | 0.4 | 294 | 1 | 294 | 1 | null | null | null | null | 4 | P b c a | -P 2ac 2ab | 61 | (2R/2S)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoic acid | - C17 H15 N O3 - | - C17 H15 N O3 - | - C136 H120 N8 O24 - | 8 | 1 | CF1250 | Brady, Fiona; Gallagher, John F.; Kenny, Peter T. M. | O—H···O, C—H···O and C—H···π~arene~ Intermolecular Interactions in (2<i>R</i>/2<i>S</i>)-2-(1-oxo-1,3-dihydroisoindol-2-yl)-3-phenylpropanoic Acid | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1523 | 1525 | 10.1107/S0108270198005678 | 0.7107 | MoKα | 0.085 | 0.041 | null | null | null | 0.098 | null | null | null | null | null | 1.013 | null | null | has coordinates,has Fobs | Brady, Fiona; Gallagher, John F.; Kenny, Peter T. M.
O—H···O, C—H···O and C—H···π~arene~ Intermolecular Interactions in (2<i>R</i>/2<i>S</i>)-2-(1-oxo-1,3-dihydroisoindol-2-yl)-3-phenylpropanoic Acid
Acta Crystallographica Section C
54(10)
(1998)
1523-1525 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007714.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,715 | 13.274 | 0.002 | 12.214 | 0.004 | 15.044 | 0.003 | 90 | null | 110.606 | 0.014 | 90 | null | 2,283 | 1 | 123 | null | 123 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 2,8-Dimethylphenoxathiin-10-oxide | - C14 H12 O2 S - | - C14 H12 O2 S - | - C112 H96 O16 S8 - | 8 | 2 | CF1253 | Bennett, Stephen R.; Kennedy, Alan R.; Khalaf, Abedawn I.; Waigh, Roger D. | 2,8-Dimethylphenoxathiin 10-Oxide | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1511 | 1513 | 10.1107/S0108270198005903 | 0.71069 | MoKα | 0.107 | 0.058 | null | null | null | 0.17 | null | null | null | null | null | 1.036 | null | null | has coordinates | Bennett, Stephen R.; Kennedy, Alan R.; Khalaf, Abedawn I.; Waigh, Roger D.
2,8-Dimethylphenoxathiin 10-Oxide
Acta Crystallographica Section C
54(10)
(1998)
1511-1513 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007715.cif $
#-------------------------------------------------------------------... | ||||||||||
2,229,967 | 12.2833 | 0.0016 | 12.2833 | 0.0016 | 14.002 | 0.004 | 90 | null | 90 | null | 90 | null | 2,112.6 | 0.7 | 273 | 2 | 273 | 2 | null | null | null | null | 6 | P 43 | P 4cw | 78 | 2-Bromo-<i>N</i>-(dibenzylcarbamothioyl)benzamide | - C22 H19 Br N2 O S - | - C22 H19 Br N2 O S - | - C88 H76 Br4 N8 O4 S4 - | 4 | 1 | DN2677 | Nasir, Mohd Faizal Md; Hassan, Ibrahim N.; Wan Daud, Wan Ramli; Yamin, Bohari M.; Kassim, Mohammad B. | 2-Bromo-<i>N</i>-(dibenzylcarbamothioyl)benzamide | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1218 | 10.1107/S1600536811014711 | 0.71073 | MoKα | 0.128 | 0.0498 | null | null | 0.0992 | 0.1184 | null | null | null | null | null | 0.933 | null | null | has coordinates,has Fobs | Nasir, Mohd Faizal Md; Hassan, Ibrahim N.; Wan Daud, Wan Ramli; Yamin, Bohari M.; Kassim, Mohammad B.
2-Bromo-<i>N</i>-(dibenzylcarbamothioyl)benzamide
Acta Crystallographica Section E
67(5)
(2011)
o1218 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229967.cif $
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2,007,716 | 10.5933 | 0.0006 | 8.8517 | 0.0007 | 11.3495 | 0.0006 | 90 | null | 91.606 | 0.004 | 90 | null | 1,063.81 | 0.12 | 287 | 2 | 287 | 2 | null | null | null | null | 4 | P 1 2/a 1 | -P 2ya | 13 | 10-bornanesulfonic acid 2-hydroxy-γ-sultone | endo-10,10-dimethyl-4-oxa-5-thiatricyclo[5.2.1.0^3,7^]decane-S,S-dioxide | - C10 H16 O3 S - | - C10 H16 O3 S - | - C40 H64 O12 S4 - | 4 | 1 | CF1262 | Muir, Kenneth W.; Rodger, Colin S.; Morris, David G.; Ryder, Karl S. | A Sultone Derived from Racemic Camphene | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1546 | 1548 | 10.1107/S0108270198006179 | 0.71073 | MoKα | 0.056 | 0.035 | null | 0.11 | 0.095 | null | null | null | 1.008 | 1.017 | 1.017 | null | null | null | has coordinates | Muir, Kenneth W.; Rodger, Colin S.; Morris, David G.; Ryder, Karl S.
A Sultone Derived from Racemic Camphene
Acta Crystallographica Section C
54(10)
(1998)
1546-1548 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007716.cif $
#-------------------------------------------------------------------... | |||||||||
2,007,717 | 8.7171 | 0.0008 | 10.9766 | 0.0012 | 21.946 | 0.004 | 90 | null | 90 | null | 90 | null | 2,099.9 | 0.5 | 291 | 2 | 291 | 2 | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | Gomisin N | 1,2,3,12-tetramethoxy-6,7-dimethyl- 10,11-methylenedioxy-5,6,7,8-tetrahydrodibenzo[a,c]cyclooctene | - C23 H28 O6 - | - C23 H28 O6 - | - C92 H112 O24 - | 4 | 1 | DA1014 | Marek, Jaromír; Slanina, Jiří | Gomisin N | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1548 | 1550 | 10.1107/S0108270198006489 | 0.71073 | MoKα | 0.055 | 0.036 | null | null | null | 0.1 | null | null | null | null | null | 0.955 | null | null | has coordinates | Marek, Jaromír; Slanina, Jiří
Gomisin N
Acta Crystallographica Section C
54(10)
(1998)
1548-1550 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007717.cif $
#-------------------------------------------------------------------... | |||||||||
2,007,718 | 22.7727 | 0.0004 | 38.3529 | 0.0007 | 9.631 | 0.0002 | 90 | null | 90 | null | 90 | null | 8,411.7 | 0.3 | 297 | 2 | 297 | 2 | null | null | null | null | 3 | F d d 2 | F 2 -2d | 43 | calanone | - C27 H20 O5 - | - C27 H20 O5 - | - C432 H320 O80 - | 16 | 1 | DE1085 | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow | Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1536 | 1540 | 10.1107/S0108270198005691 | 0.71073 | MoKα | 0.039 | 0.034 | null | 0.084 | 0.081 | null | null | null | 1.036 | 1.047 | 1.047 | null | null | null | has coordinates | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow
Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A
Acta Crystallographica Section C
54(10)
(1998)
1536-1540 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007718.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,719 | 6.0017 | 0.0003 | 27.3003 | 0.0013 | 12.8273 | 0.0006 | 90 | null | 95.303 | 0.001 | 90 | null | 2,092.73 | 0.17 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | isocalanone | - C27 H20 O5 - | - C27 H20 O5 - | - C108 H80 O20 - | 4 | 1 | DE1085 | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow | Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1536 | 1540 | 10.1107/S0108270198005691 | 0.71073 | MoKα | 0.08 | 0.049 | null | 0.12 | 0.107 | null | null | null | 1.053 | 1.153 | 1.153 | null | null | null | has coordinates | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow
Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A
Acta Crystallographica Section C
54(10)
(1998)
1536-1540 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007719.cif $
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2,007,720 | 9.0418 | 0.0005 | 16.7577 | 0.001 | 14.1879 | 0.0009 | 90 | null | 106.315 | 0.001 | 90 | null | 2,063.2 | 0.2 | 296 | 2 | 296 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | teysmanone A | - C27 H20 O5 - | - C27 H20 O5 - | - C108 H80 O20 - | 4 | 1 | DE1085 | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow | Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1536 | 1540 | 10.1107/S0108270198005691 | 0.71073 | MoKα | 0.092 | 0.056 | null | 0.128 | 0.114 | null | null | null | 1.057 | 1.151 | 1.151 | null | null | null | has coordinates | Vittal, Jagadese J.; Cao, Shu-Geng; Goh, Swee-Hock; Tan, Goek-Kheng; Sim, Keng-Yeow
Three Novel Isomeric Pyranocoumarins from <i>Calophyllum teysmannii</i>: Calanone, Isocalanone and Teysmanone A
Acta Crystallographica Section C
54(10)
(1998)
1536-1540 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007720.cif $
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2,229,966 | 10.3992 | 0.0005 | 7.6402 | 0.0004 | 35.4173 | 0.0016 | 90 | null | 90 | null | 90 | null | 2,814 | 0.2 | 173 | 2 | 173 | 2 | null | null | null | null | 5 | P b c a | -P 2ac 2ab | 61 | Dicarbonyl(η^5^-cyclopentadienyl)[2-(phenylsulfanyl)ethyl]iron(II) | - C15 H14 Fe O2 S - | - C15 H14 Fe O2 S - | - C120 H112 Fe8 O16 S8 - | 8 | 1 | DN2676 | Mkhize, Dennis S.; Nyamori, Vincent O.; Bala, Muhammad D. | Dicarbonyl(η^5^-cyclopentadienyl)[2-(phenylsulfanyl)ethyl]iron(II) | Acta Crystallographica Section E | 2,011 | 67 | 5 | m644 | 10.1107/S160053681101511X | 0.71073 | MoKα | 0.0862 | 0.0747 | null | null | 0.1493 | 0.1531 | null | null | null | null | null | 1.262 | null | null | has coordinates,has Fobs | Mkhize, Dennis S.; Nyamori, Vincent O.; Bala, Muhammad D.
Dicarbonyl(η^5^-cyclopentadienyl)[2-(phenylsulfanyl)ethyl]iron(II)
Acta Crystallographica Section E
67(5)
(2011)
m644 | 176,789 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229966.cif $
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2,007,721 | 7.074 | 0.001 | 11.052 | 0.001 | 15.086 | 0.002 | 90.22 | 0.01 | 91.85 | 0.01 | 105.37 | 0.01 | 1,136.6 | 0.2 | 296 | 2 | 296 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | potassium(benzo-15-crown-5)picrate | [Potassium(2,3-benzo-1,4,7,10,13-pentaoxacyclopenta-dec-2-ene)picrate] | - C20 H22 K N3 O12 - | - C20 H22 K N3 O11.98 - | - C40 H44 K2 N6 O23.96 - | 2 | 1 | FG1402 | Dong, Wenkui; Yang, Rudong; Yu, Kaibei | <i>catena</i>-Poly[[(2,3-benzo-1,4,7,10,13-pentaoxacyclopentadec-2-ene-κ^5^<i>O</i>)potassium]-μ-(picrato-<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^5^)] | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1416 | 1418 | 10.1107/S0108270198003151 | 0.71073 | MoKα | 0.062 | 0.048 | null | 0.146 | 0.139 | null | null | null | 1.1 | 1.203 | 1.203 | null | null | null | has coordinates,has disorder | Dong, Wenkui; Yang, Rudong; Yu, Kaibei
<i>catena</i>-Poly[[(2,3-benzo-1,4,7,10,13-pentaoxacyclopentadec-2-ene-κ^5^<i>O</i>)potassium]-μ-(picrato-<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^5^)]
Acta Crystallographica Section C
54(10)
(1998)
1416-1418 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007721.cif $
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2,007,722 | 13.18 | 0.002 | 13.555 | 0.003 | 13.267 | 0.002 | 90 | null | 118.23 | 0.02 | 90 | null | 2,088.3 | 0.8 | 200 | 1 | 200 | 1 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 1,1,3,3,14,14,16,16,18,18,29,29-Dodecamethyl-1,16-distanna-3,14,18,29- tetrasila(5,5)ferrocenophane | - C36 H60 Fe2 Si4 Sn2 - | - C36 H60 Fe2 Si4 Sn2 - | - C72 H120 Fe4 Si8 Sn4 - | 2 | 0.5 | FG1430 | Olivier Gausset; Guylaine Delpon-Lacaze; Markus Schürmann; Klaus Jurkschat | 1,1,3,3,14,14,16,16,18,18,29,29-Dodecamethyl-3,14,18,29-tetrasila-1,16-distanna[5.5]ferrocenophane | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1425 | 1427 | 10.1107/S0108270198006088 | 0.71069 | MoKα | 0.034 | 0.022 | null | 0.054 | 0.05 | null | null | null | 1.054 | 1.081 | 1.081 | null | null | null | has coordinates | Olivier Gausset; Guylaine Delpon-Lacaze; Markus Schürmann; Klaus Jurkschat
1,1,3,3,14,14,16,16,18,18,29,29-Dodecamethyl-3,14,18,29-tetrasila-1,16-distanna[5.5]ferrocenophane
Acta Crystallographica Section C
54(10)
(1998)
1425-1427 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007722.cif $
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2,007,723 | 8.207 | 0.002 | 17.445 | 0.002 | 11.151 | 0.001 | 90 | null | 93.69 | 0.01 | 90 | null | 1,593.2 | 0.5 | 296 | null | 296 | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | 5-aminoisophthalic acid hemihydrate | - C8 H8 N O4.5 - | - C8 H8 N O4.5 - | - C64 H64 N8 O36 - | 8 | 1 | FG1449 | Dobson, Allison J.; Gerkin, Roger E. | 5-Aminoisophthalic Acid Hemihydrate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1503 | 1505 | 10.1107/S0108270198005915 | 0.71073 | MoKα | null | 0.043 | null | null | 0.074 | null | null | null | null | 1.8 | 1.8 | null | null | null | has coordinates | Dobson, Allison J.; Gerkin, Roger E.
5-Aminoisophthalic Acid Hemihydrate
Acta Crystallographica Section C
54(10)
(1998)
1503-1505 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007723.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,724 | 7.2501 | 0.0005 | 22.917 | 0.0002 | 9.1648 | 0.0007 | 90 | null | 92.443 | 0.009 | 90 | null | 1,521.35 | 0.16 | 220 | 2 | 220 | 2 | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C12 H26 Cl2 I6 N2 Pd2 S4 - | - C12 H26 Cl2 I6 N2 Pd2 S4 - | - C24 H52 Cl4 I12 N4 Pd4 S8 - | 2 | 0.5 | FG1461 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin | Dichloro(μ-[18]aneN~2~S~4~)dipalladium(II) Bis(triiodide) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1408 | 1410 | 10.1107/S0108270198005927 | 0.71073 | MoKα | 0.051 | 0.035 | null | null | null | 0.087 | null | null | null | null | null | 1.03 | null | null | has coordinates,has disorder | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin
Dichloro(μ-[18]aneN~2~S~4~)dipalladium(II) Bis(triiodide)
Acta Crystallographica Section C
54(10)
(1998)
1408-1410 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007724.cif $
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2,229,965 | 19.725 | 0.006 | 11.054 | 0.003 | 20.7 | 0.005 | 90 | null | 91.252 | 0.009 | 90 | null | 4,512 | 2 | 298 | 2 | 298 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | (±)-1,2-Bis(<i>N</i>'-benzoylthioureido)cyclohexane | (±)-1-Benzoyl-3-[2-(<i>N</i>'-benzoylthioureido)cyclohexyl]thiourea | - C22 H24 N4 O2 S2 - | - C22 H24 N4 O2 S2 - | - C176 H192 N32 O16 S16 - | 8 | 1 | DN2675 | Jumal, Juliana; Ibrahim, Abdul Razak; Yamin, Bohari M. | (±)-1,2-Bis(<i>N</i>'-benzoylthioureido)cyclohexane | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1256 | 10.1107/S1600536811014991 | 0.71073 | MoKα | 0.0834 | 0.0624 | null | null | 0.1363 | 0.1454 | null | null | null | null | null | 1.107 | null | null | has coordinates,has Fobs | Jumal, Juliana; Ibrahim, Abdul Razak; Yamin, Bohari M.
(±)-1,2-Bis(<i>N</i>'-benzoylthioureido)cyclohexane
Acta Crystallographica Section E
67(5)
(2011)
o1256 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229965.cif $
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2,007,725 | 10.005 | 0.002 | 16.556 | 0.002 | 3.927 | 0.001 | 90 | null | 99.26 | 0.01 | 90 | null | 642 | 0.2 | 293 | null | null | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | - C16 H6 S2 - | - C16 H6 S2 - | - C32 H12 S4 - | 2 | 0.5 | FR1072 | Sarkar, Abhijit; Komatsu, Kyoji; Okada, Shuji; Matsuda, Hiro; Nakanishi, Hachiro | 1,8-Bis(2-thienyl)-1,3,5,7-octatetrayne | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1519 | 1521 | 10.1107/S0108270198005605 | 0.71073 | MoKα | null | 0.074 | null | null | 0.056 | null | null | null | null | 1.805 | 1.805 | null | null | null | has coordinates,has disorder | Sarkar, Abhijit; Komatsu, Kyoji; Okada, Shuji; Matsuda, Hiro; Nakanishi, Hachiro
1,8-Bis(2-thienyl)-1,3,5,7-octatetrayne
Acta Crystallographica Section C
54(10)
(1998)
1519-1521 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007725.cif $
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2,007,726 | 5.9103 | 0.0004 | 28.2842 | 0.0019 | 5.0635 | 0.0003 | 90 | null | 93.975 | 0.007 | 90 | null | 844.42 | 0.1 | 295 | 1 | 295 | 1 | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | S,S-trans-2,3-tetralindiol | (S,S)-trans-1,2,3,4-tetrahydro-2,3-naphthalenediol | - C10 H12 O2 - | - C10 H12 O2 - | - C40 H48 O8 - | 4 | 2 | FR1110 | Michael A. Lloyd; Garth E. Patterson; Brock, Carolyn Pratt | (<i>S</i>,<i>S</i>)-<i>trans</i>-2,3-Tetralindiol | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1486 | 1488 | 10.1107/S010827019800537X | 0.71073 | MoKα | 0.069 | 0.031 | null | 0.076 | 0.065 | null | null | null | 1.021 | 1.103 | 1.103 | null | null | null | has coordinates | Michael A. Lloyd; Garth E. Patterson; Brock, Carolyn Pratt
(<i>S</i>,<i>S</i>)-<i>trans</i>-2,3-Tetralindiol
Acta Crystallographica Section C
54(10)
(1998)
1486-1488 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007726.cif $
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2,007,727 | 19.862 | 0.001 | 21.301 | 0.001 | 9.758 | 0.001 | 90 | null | 90 | null | 90 | null | 4,128.4 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P b c a | -P 2ac 2ab | 61 | 3-(o-Carboxyphenyl)-1-ethyltriazene 1-Oxide | 3-(o-Carboxyphenyl)-1-ethyltriazene 1-Oxide | - C9 H11 N3 O3 - | - C9 H11 N3 O3 - | - C144 H176 N48 O48 - | 16 | 2 | HA1213 | Chitra Samanta; Alok Kumar Mukherjee; Monika Mukherjee | 3-(<i>o</i>-Carboxyphenyl)-1-ethyltriazene 1-Oxide | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1544 | 1546 | 10.1107/S0108270198003862 | 1.54178 | CuKα | 0.0811 | 0.0489 | null | 0.1342 | 0.1211 | null | null | null | 0.948 | 1.063 | 1.063 | null | null | null | has coordinates | Chitra Samanta; Alok Kumar Mukherjee; Monika Mukherjee
3-(<i>o</i>-Carboxyphenyl)-1-ethyltriazene 1-Oxide
Acta Crystallographica Section C
54(10)
(1998)
1544-1546 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007727.cif $
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2,007,728 | 8.4255 | 0.0002 | 8.5771 | 0.0002 | 14.5531 | 0.0002 | 89.692 | 0.001 | 85.374 | 0.002 | 61.295 | 0.001 | 918.78 | 0.03 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | 2,6-dihydroxy-4-(6'-hydroxy-2',4'-dimethoxy-3'-methylbenzoyloxy)-3- methylbenzoate | - C19 H20 O9 - | - C19 H20 O9 - | - C38 H40 O18 - | 2 | 1 | HA1218 | Kan Chantrapromma; Rapeeporn Sortiruk; Suchada Chantrapromma; Chanita Ponglimanont; Hoong-Kun Fun; Kandasamy Chinnakali | Methyl 2,6-Dihydroxy-4-(2-hydroxy-4,6-dimethoxy-3-methylbenzoyloxy)-3-methylbenzoate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1494 | 1496 | 10.1107/S0108270198005058 | 0.71073 | MoKα | 0.0667 | 0.0492 | null | 0.1493 | 0.1313 | null | null | null | 1.054 | 1.082 | 1.082 | null | null | null | has coordinates | Kan Chantrapromma; Rapeeporn Sortiruk; Suchada Chantrapromma; Chanita Ponglimanont; Hoong-Kun Fun; Kandasamy Chinnakali
Methyl 2,6-Dihydroxy-4-(2-hydroxy-4,6-dimethoxy-3-methylbenzoyloxy)-3-methylbenzoate
Acta Crystallographica Section C
54(10)
(1998)
1494-1496 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007728.cif $
#-------------------------------------------------------------------... | ||||||||||
2,007,729 | 17.298 | 0.001 | 10.738 | 0.001 | 12.453 | 0.001 | 90 | null | 95.43 | 0.01 | 90 | null | 2,302.7 | 0.3 | 173 | 1 | 173 | 1 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | Di-t-butyl cis-transoid-cis-perhydro-3,3,6,6-tetramethyl-1,4- dioxocyclobuta[1,2-c:3,4-c']-dipyrrole-2,5-dicarboxylate | - C22 H34 N2 O6 - | - C22 H34 N2 O6 - | - C88 H136 N8 O24 - | 4 | 0.5 | JZ1280 | Kopf, Jürgen; Wrobel, Matthias Nils; Margaretha, Paul | The 3,3,6,6-Tetramethyl <i>cis</i>-<i>transoid</i>-<i>cis</i>-Photocyclodimer of <i>tert</i>-Butyl 2,5-Dihydro-5,5-dimethyl-2-oxo-1<i>H</i>-pyrrole-1-carboxylate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1499 | 1501 | 10.1107/S0108270198005344 | 1.54178 | CuKα | 0.045 | 0.045 | null | null | null | 0.114 | null | null | null | null | null | 1.078 | null | null | has coordinates | Kopf, Jürgen; Wrobel, Matthias Nils; Margaretha, Paul
The 3,3,6,6-Tetramethyl <i>cis</i>-<i>transoid</i>-<i>cis</i>-Photocyclodimer of <i>tert</i>-Butyl 2,5-Dihydro-5,5-dimethyl-2-oxo-1<i>H</i>-pyrrole-1-carboxylate
Acta Crystallographica Section C
54(10)
(1998)
1499-1501 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007729.cif $
#-------------------------------------------------------------------... | ||||||||||
2,229,964 | 9.6465 | 0.0009 | 10.3796 | 0.001 | 16.3341 | 0.0016 | 102.931 | 0.002 | 102.082 | 0.002 | 93.184 | 0.002 | 1,549.7 | 0.3 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | <i>rac</i>-(<i>OC</i>-6-33)-Bis[2-(<i>N</i>-benzyliminomethyl-κ<i>N</i>)- 1<i>H</i>-imidazol-1-ido-κ<i>N</i>^1^]bis(ethylamido)titanium(IV) | - C30 H40 N8 Ti - | - C30 H40 N8 Ti - | - C60 H80 N16 Ti2 - | 2 | 1 | DN2674 | Li, Zhao; Nie, Wanli; Borzov, Maxim V. | <i>rac</i>-(<i>OC</i>-6-33)-bis[2-(<i>N</i>-Benzylmethyliminomethyl-κ<i>N</i>)-1<i>H</i>-imidazol-1-ido-κ<i>N</i>^1^]bis(ethylamido)titanium(IV) | Acta Crystallographica Section E | 2,011 | 67 | 5 | m590 | m591 | 10.1107/S1600536811013183 | 0.71073 | MoKα | 0.091 | 0.0443 | null | null | 0.0897 | 0.0997 | null | null | null | null | null | 0.939 | null | null | has coordinates,has Fobs | Li, Zhao; Nie, Wanli; Borzov, Maxim V.
<i>rac</i>-(<i>OC</i>-6-33)-bis[2-(<i>N</i>-Benzylmethyliminomethyl-κ<i>N</i>)-1<i>H</i>-imidazol-1-ido-κ<i>N</i>^1^]bis(ethylamido)titanium(IV)
Acta Crystallographica Section E
67(5)
(2011)
m590-m591 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229964.cif $
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2,007,730 | 12.386 | 0.002 | 11.732 | 0.002 | 12.845 | 0.002 | 90 | null | 112.08 | 0.01 | 90 | null | 1,729.6 | 0.5 | 173 | 2 | 173 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Bis(diisopropylammonium) hexafluorosilicate(IV) | - C12 H32 F6 N2 Si - | - C12 H32 F6 N2 Si - | - C48 H128 F24 N8 Si4 - | 4 | 0.5 | JZ1289 | Reiß, Guido J. | Bis(diisopropylammonium) Hexafluorosilicate(IV) | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1489 | 1491 | 10.1107/S010827019800609X | 0.71073 | MoKα | 0.042 | 0.03 | null | null | null | 0.076 | null | null | null | null | null | 1.036 | null | null | has coordinates | Reiß, Guido J.
Bis(diisopropylammonium) Hexafluorosilicate(IV)
Acta Crystallographica Section C
54(10)
(1998)
1489-1491 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007730.cif $
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2,007,731 | 11.0034 | 0.0002 | 27.2848 | 0.0004 | 6.7194 | 0.0001 | 90 | null | 90 | null | 90 | null | 2,017.34 | 0.06 | 173 | null | 173 | null | null | null | null | null | 5 | P n a 21 | P 2c -2n | 33 | 1,1-Bis-(N-Methylimidazol)-silacyclohexane dibromide acetonitrile solvate | - C15 H25 Br2 N5 Si - | - C15 H25 Br2 N5 Si - | - C60 H100 Br8 N20 Si4 - | 4 | 1 | JZ1295 | Hensen, Karl; Gebhardt, Frank; Bolte, Michael | 3,3'-(1-Silacyclohexane-1,1-diyl)bis(1-methylimidazolium) Dibromide Acetonitrile Solvate at 173K | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1462 | 1464 | 10.1107/S0108270198006763 | 0.71073 | MoKα | 0.073 | 0.065 | null | 0.172 | 0.164 | 0.172 | null | null | 1.01 | null | null | 1.01 | null | null | has coordinates | Hensen, Karl; Gebhardt, Frank; Bolte, Michael
3,3'-(1-Silacyclohexane-1,1-diyl)bis(1-methylimidazolium) Dibromide Acetonitrile Solvate at 173K
Acta Crystallographica Section C
54(10)
(1998)
1462-1464 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007731.cif $
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2,007,732 | 11.711 | 0.001 | 11.711 | 0.001 | 11.696 | 0.001 | 90 | null | 90 | null | 90 | null | 1,604.1 | 0.2 | 298 | 2 | 298 | 2 | null | null | null | null | 6 | I -4 2 m | I -4 2 | 121 | Tetrabetainecopper(II) perchlorate | Tetrakis(trimethylammonioacetato-O)copper(II) diperchlorate | - C20 H44 Cl2 Cu N4 O16 - | - C20 H44 Cl2 Cu N4 O16 - | - C40 H88 Cl4 Cu2 N8 O32 - | 2 | 0.125 | KA1268 | Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang | Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1389 | 1393 | 10.1107/S010827019800523X | 0.71073 | MoKα | 0.034 | 0.034 | null | null | null | 0.087 | null | null | null | null | null | 0.936 | null | null | has coordinates,has disorder | Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang
Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate
Acta Crystallographica Section C
54(10)
(1998)
1389-1393 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007732.cif $
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2,007,733 | 12.6528 | 0.0008 | 25.849 | 0.001 | 5.7717 | 0.0004 | 90 | null | 102.626 | 0.004 | 90 | null | 1,842.06 | 0.19 | 298 | 2 | 298 | 2 | null | null | null | null | 7 | C 1 m 1 | C -2y | 8 | Sodium tetrabetainecopper(II) perchlorate | Perchlorato-2κO-bis(μ-trimethylammonioacetato)-1:2κ^4^O- bis(trimethylammonioacetato)-1κ^2^O-coppersodium diperchlorate | - C20 H44 Cl3 Cu N4 Na O20 - | - C20 H44 Cl3 Cu N4 Na O20 - | - C40 H88 Cl6 Cu2 N8 Na2 O40 - | 2 | 0.5 | KA1268 | Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang | Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1389 | 1393 | 10.1107/S010827019800523X | 0.71073 | MoKα | 0.085 | 0.075 | null | null | null | 0.195 | null | null | null | null | null | 1.466 | null | null | has coordinates,has disorder | Ng, Seik Weng; Chen, Xiao-Ming; Yang, Guang
Metallo-Ligand [Cu^II^(carboxylato)~4~]^2+^ Cores: Tetrakis(trimethylammonioacetato-<i>O</i>)copper Diperchlorate and its 1/1 Complex with Sodium Perchlorate
Acta Crystallographica Section C
54(10)
(1998)
1389-1393 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007733.cif $
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2,229,963 | 19.6589 | 0.0014 | 11.5155 | 0.0008 | 12.4185 | 0.0018 | 90 | null | 125.74 | 0.001 | 90 | null | 2,281.9 | 0.4 | 93 | 2 | 93 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | 2,2,2-Tris(pyrazol-1-yl)ethanol | - C11 H12 N6 O - | - C11 H12 N6 O - | - C88 H96 N48 O8 - | 8 | 1 | DN2673 | McLauchlan, Craig C.; Smith, Brigette L.; Pippins, Reyhana S.; Nelson, Brandon M. | 2,2,2-Tris(pyrazol-1-yl)ethanol | Acta Crystallographica Section E | 2,011 | 67 | 5 | o1133 | o1134 | 10.1107/S1600536811012931 | 0.71073 | MoKα | 0.0353 | 0.0335 | null | null | 0.0855 | 0.087 | null | null | null | null | null | 1.045 | null | null | has coordinates,has Fobs | McLauchlan, Craig C.; Smith, Brigette L.; Pippins, Reyhana S.; Nelson, Brandon M.
2,2,2-Tris(pyrazol-1-yl)ethanol
Acta Crystallographica Section E
67(5)
(2011)
o1133-o1134 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/22/99/2229963.cif $
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2,007,734 | 12.167 | 0.001 | 14.712 | 0.002 | 10.18 | 0.001 | 90 | null | 103.48 | 0.01 | 90 | null | 1,772 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Poly[bis(benzimidazole-N^3^)copper(II)-μ-aqua-μ- acetylenedicarboxylato-O:O'] | - C18 H14 Cu N4 O5 - | - C18 H14 Cu N4 O5 - | - C72 H56 Cu4 N16 O20 - | 4 | 0.5 | KA1272 | Sieroń, Lesław; Bukowska-Strzyżewska, Maria | Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>'] | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1431 | 1435 | 10.1107/S0108270198004880 | 0.71073 | MoKα | 0.034 | 0.028 | null | null | 0.069 | 0.071 | null | null | null | null | null | 1.08 | null | null | has coordinates | Sieroń, Lesław; Bukowska-Strzyżewska, Maria
Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>']
Acta Crystallographica Section C
54(10)
(1998)
1431-1435 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007734.cif $
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2,007,735 | 12.941 | 0.002 | 13.292 | 0.002 | 10.398 | 0.002 | 90 | null | 100.09 | 0.01 | 90 | null | 1,760.9 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Poly[bis(benzimidazole-N^3^)copper(II)-μ-aqua-μ-fumarato-O:O'] | - C18 H16 Cu N4 O5 - | - C18 H16 Cu N4 O5 - | - C72 H64 Cu4 N16 O20 - | 4 | 0.5 | KA1272 | Sieroń, Lesław; Bukowska-Strzyżewska, Maria | Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>'] | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1431 | 1435 | 10.1107/S0108270198004880 | 0.71073 | MoKα | 0.048 | 0.035 | null | null | 0.076 | 0.079 | null | null | null | null | null | 1.063 | null | null | has coordinates | Sieroń, Lesław; Bukowska-Strzyżewska, Maria
Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-acetylenedicarboxylato-<i>O</i>:<i>O</i>'-μ-aqua] and Poly[bis(benzimidazole-<i>N</i>^3^)copper(II)-μ-aqua-μ-fumarato-<i>O</i>:<i>O</i>']
Acta Crystallographica Section C
54(10)
(1998)
1431-1435 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
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2,007,736 | 9.346 | 0.002 | 4.5979 | 0.0012 | 13.7798 | 0.0014 | 90 | null | 105.164 | 0.011 | 90 | null | 571.5 | 0.2 | 200 | 2 | 200 | 2 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 6-carboxy-2-pyridone | - C6 H5 N O3 - | - C6 H5 N O3 - | - C24 H20 N4 O12 - | 4 | 1 | KA1286 | Sawada, Keiju; Ohashi, Yuji | 2-Oxo-1,2-dihydropyridine-6-carboxylic Acid | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1491 | 1493 | 10.1107/S0108270198007446 | 1.54184 | CuKα | 0.093 | 0.051 | null | null | null | 0.161 | null | null | null | null | null | 1.024 | null | null | has coordinates | Sawada, Keiju; Ohashi, Yuji
2-Oxo-1,2-dihydropyridine-6-carboxylic Acid
Acta Crystallographica Section C
54(10)
(1998)
1491-1493 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,007,737 | 6.6977 | 0.0007 | 7.9438 | 0.0005 | 10.81 | 0.0013 | 72.643 | 0.008 | 85.549 | 0.009 | 88.011 | 0.007 | 547.26 | 0.1 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 | P 1 | 1 | Complex of (-)-Morphine with β-Phenylhydracrylic Acid | - C26 H29 N O6 - | - C26 H29 N O6 - | - C26 H29 N O6 - | 1 | 1 | LN1054 | Lutz, Martin; Spek, Anthony L. | Complex of ({-})-Morphine with β-Phenylhydracrylic Acid | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1477 | 1479 | 10.1107/S010827019800506X | 0.71073 | MoKα | 0.1096 | 0.0507 | null | null | null | 0.1215 | null | null | null | null | null | 1.049 | null | null | has coordinates | Lutz, Martin; Spek, Anthony L.
Complex of ({-})-Morphine with β-Phenylhydracrylic Acid
Acta Crystallographica Section C
54(10)
(1998)
1477-1479 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,007,738 | 11.632 | 0.003 | 11.835 | 0.002 | 22.412 | 0.004 | 90 | null | 100.28 | 0.03 | 90 | null | 3,035.8 | 1.1 | 210 | 2 | 210 | 0.2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C12 H24 Cl2 I7 Rh S4 - | - C12 H24 Cl2 I7 Rh S4 - | - C48 H96 Cl8 I28 Rh4 S16 - | 4 | 1 | LN1058 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin | <i>trans</i>-Dichloro([16]aneS~4~)rhodium(III) Pentaiodide Diiodine | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1410 | 1413 | 10.1107/S0108270198005964 | 0.71073 | MoKα | 0.09 | 0.062 | null | 0.134 | 0.116 | null | null | null | 1.235 | 1.225 | 1.225 | null | null | null | has coordinates | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Schröder, Martin
<i>trans</i>-Dichloro([16]aneS~4~)rhodium(III) Pentaiodide Diiodine
Acta Crystallographica Section C
54(10)
(1998)
1410-1413 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,007,739 | 7.32 | 0.005 | 8.307 | 0.005 | 16.399 | 0.005 | 81.23 | 0.05 | 98.52 | 0.05 | 104.46 | 0.05 | 948 | 0.9 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C18 H17 N O4 S3 - | - C18 H17 N O4 S3 - | - C36 H34 N2 O8 S6 - | 2 | 1 | MU1359 | D.TranQui; P. Fresneau; M.Cussac | (<i>Z</i>)-5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidine-3-acetic Acid Dimethyl Sulfoxide Solvate | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1501 | 1503 | 10.1107/S0108270198004600 | 0.71073 | MoKα | 0.0573 | 0.0437 | null | 0.137 | 0.1 | null | null | null | 0.974 | 0.897 | 0.897 | null | null | null | has coordinates | D.TranQui; P. Fresneau; M.Cussac
(<i>Z</i>)-5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidine-3-acetic Acid Dimethyl Sulfoxide Solvate
Acta Crystallographica Section C
54(10)
(1998)
1501-1503 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,229,962 | 6.9972 | 0.0004 | 8.8164 | 0.0005 | 17.1495 | 0.001 | 96.218 | 0.003 | 99.137 | 0.003 | 98.329 | 0.003 | 1,024.13 | 0.1 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | Diaqua(1,4,8,11-tetraazacyclotetradecane- κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)copper(II) didodecanoate dihydrate | - C34 H78 Cu N4 O8 - | - C34 H78 Cu N4 O8 - | - C34 H78 Cu N4 O8 - | 1 | 0.5 | DN2672 | Ahmad Tajidi, Nur Syamimi; Abdullah, Norbani; Arifin, Zainudin | Diaqua(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)copper(II) didodecanoate dihydrate | Acta Crystallographica Section E | 2,011 | 67 | 5 | m588 | m589 | 10.1107/S1600536811012773 | 0.71073 | MoKα | 0.0516 | 0.0466 | null | null | 0.1241 | 0.1287 | null | null | null | null | null | 1.066 | null | null | has coordinates,has Fobs | Ahmad Tajidi, Nur Syamimi; Abdullah, Norbani; Arifin, Zainudin
Diaqua(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)copper(II) didodecanoate dihydrate
Acta Crystallographica Section E
67(5)
(2011)
m588-m589 | 301,805 | 2025-08-19 | 13:58:39 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 16:18:28 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301805 $
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2,007,740 | 9.0038 | 0.0006 | 12.413 | 0.0005 | 6.6728 | 0.0008 | 96.458 | 0.006 | 99.231 | 0.008 | 75.48 | 0.004 | 710.57 | 0.1 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | 4-Hydroxy-3-Methoxycarbonyl-2-Dimethoxyphosphoryl-2H-1-Benzopyran | - C13 H15 O7 P - | - C13 H15 O8 P - | - C26 H30 O16 P2 - | 2 | 1 | NA1323 | Olszak, Tomasz A.; Grabowski, Mieczysław J.; Modranka, R.; Kostka, K.; Olszak, Agnieszka | 2<i>H</i>-1-Benzopyrans. III. 4-Hydroxy-3-methoxycarbonyl-2-dimethoxyphosphoryl-2<i>H</i>-1-benzopyran | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1459 | 1461 | 10.1107/S0108270198005241 | 1.54178 | CuKα | 0.055 | 0.047 | null | 0.142 | 0.139 | null | null | null | 1.142 | 1.231 | 1.231 | null | null | null | has coordinates | Olszak, Tomasz A.; Grabowski, Mieczysław J.; Modranka, R.; Kostka, K.; Olszak, Agnieszka
2<i>H</i>-1-Benzopyrans. III. 4-Hydroxy-3-methoxycarbonyl-2-dimethoxyphosphoryl-2<i>H</i>-1-benzopyran
Acta Crystallographica Section C
54(10)
(1998)
1459-1461 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007740.cif $
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2,007,741 | 9.118 | 0.001 | 9.149 | 0.002 | 17.633 | 0.001 | 90 | null | 95.17 | 0.01 | 90 | null | 1,465 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline hydrochloride | 6,7-dihydroxy-1-phenyl-1,2,3,4-tetrahydroisoquinolinium chloride hydrate | - C15 H18 Cl N O3 - | - C15 H18 Cl N O3 - | - C60 H72 Cl4 N4 O12 - | 4 | 1 | NA1324 | Olszak, Tomasz A. | X-ray Structure Investigations of Potential β-Blockers. III | Acta Crystallographica Section C | 1,998 | 54 | 10 | 1456 | 1459 | 10.1107/S0108270198005459 | 1.54178 | CuKα | 0.055 | 0.027 | null | null | null | 0.057 | null | null | null | null | null | 0.788 | null | null | has coordinates,has Fobs | Olszak, Tomasz A.
X-ray Structure Investigations of Potential β-Blockers. III
Acta Crystallographica Section C
54(10)
(1998)
1456-1459 | 301,791 | 2025-08-18 | 23:15:31 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/77/2007741.cif $
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