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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,005,819 | 7.732 | 0.004 | 8.879 | 0.006 | 9.772 | 0.008 | 66.92 | 0.06 | 85.13 | 0.06 | 64.39 | 0.04 | 553.6 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 | P 1 | 1 | Lithium Bis(1,6-anhydro-β-D-glucosidato(2-)-O^2^,O^4^)cuprate(II) Octahydrate | - C12 H32 Cu Li2 O18 - | - C12 H32 Cu Li2 O18 - | - C12 H32 Cu Li2 O18 - | 1 | 1 | SK1042 | Gack, C.; Klüfers, P. | A Homoleptic Cuprate(II) Complex with Deprotonated 1,6-Anhydro-β-<small>D</small>-glucose (Levoglucosan) Ligands | Acta Crystallographica Section C | 1,996 | 52 | 12 | 2972 | 2975 | 10.1107/S010827019600947X | 0.71073 | MoKα | 0.0362 | 0.0342 | null | 0.0899 | 0.0871 | null | null | null | 1.067 | 1.054 | 1.054 | null | null | null | has coordinates | Gack, C.; Klüfers, P.
A Homoleptic Cuprate(II) Complex with Deprotonated 1,6-Anhydro-β-<small>D</small>-glucose (Levoglucosan) Ligands
Acta Crystallographica Section C
52(12)
(1996)
2972-2975 | 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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2,005,820 | 12.383 | 0.003 | 12.383 | 0.003 | 7.188 | 0.002 | 90 | null | 90 | null | 90 | null | 1,102.2 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | I -4 | I -4 | 82 | Tetraphenylphosphonium perchlorate | Tetraphenylphosphonium perchlorate | - C24 H20 Cl O4 P - | - C24 H20 Cl O4 P - | - C48 H40 Cl2 O8 P2 - | 2 | 0.25 | SK1044 | Vittal, J. J.; Dean, P. A. W. | Tetraphenylphosphonium Perchlorate | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3185 | 3188 | 10.1107/S0108270196010980 | 0.71073 | MoKα | 0.1127 | 0.0491 | null | 0.1236 | 0.0944 | null | null | null | 1.046 | 1.087 | 1.087 | null | null | null | has coordinates | Vittal, J. J.; Dean, P. A. W.
Tetraphenylphosphonium Perchlorate
Acta Crystallographica Section C
52(12)
(1996)
3185-3188 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,005,821 | 12.815 | 0.001 | 22.5637 | 0.0008 | 13.224 | 0.001 | 90 | null | 101.306 | 0.004 | 90 | null | 3,749.6 | 0.4 | 298 | 2 | 298 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | Bis(dicyclohexylammonium) aquadimethyldioxalatostannate.ethanol | - C32 H62 N2 O10 Sn - | - C32 H62 N2 O10 Sn - | - C128 H248 N8 O40 Sn4 - | 4 | 1 | SK1050 | Ng, S. W. | Bis(dicyclohexylammonium) Aquadimethyldi(oxalato-<i>O</i>,<i>O</i>')stannate Ethanol Solvate | Acta Crystallographica Section C | 1,996 | 52 | 12 | 2990 | 2992 | 10.1107/S0108270196011286 | 0.71073 | MoKα | 0.0465 | 0.0345 | null | 0.0883 | 0.0836 | null | null | null | 1.027 | 1.096 | 1.096 | null | null | null | has coordinates | Ng, S. W.
Bis(dicyclohexylammonium) Aquadimethyldi(oxalato-<i>O</i>,<i>O</i>')stannate Ethanol Solvate
Acta Crystallographica Section C
52(12)
(1996)
2990-2992 | 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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2,005,822 | 16.164 | 0.008 | 7.194 | 0.005 | 11.923 | 0.005 | 90 | null | 90 | null | 90 | null | 1,386.5 | 1.3 | 293 | 2 | 290 | 2 | null | null | null | null | 5 | P n a 21 | P 2c -2n | 33 | [(Trimethylstannyl)cyclopentadienyl]titaniumtrichloride | - C8 H13 Cl3 Sn Ti - | - C8 H13 Cl3 Sn Ti - | - C32 H52 Cl12 Sn4 Ti4 - | 4 | 1 | SK1054 | Churakov, A. V.; Kuz'mina, L. G. | Trichloro[η^5^-(trimethylstannyl)cyclopentadienyl]titanium | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3037 | 3038 | 10.1107/S0108270196011365 | 0.71069 | MoKα | 0.0666 | 0.0351 | null | 0.0913 | 0.0824 | null | null | null | 1.043 | 1.168 | 1.168 | null | null | null | has coordinates,has Fobs | Churakov, A. V.; Kuz'mina, L. G.
Trichloro[η^5^-(trimethylstannyl)cyclopentadienyl]titanium
Acta Crystallographica Section C
52(12)
(1996)
3037-3038 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
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2,005,823 | 5.1536 | 0.0002 | 12.4441 | 0.0003 | 41.2592 | 0.0011 | 90 | null | 90 | null | 90 | null | 2,646.03 | 0.14 | 133 | 2 | 133 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | - C28 H30 Cl N3 O5 - | - C28 H30 Cl N3 O5 - | - C112 H120 Cl4 N12 O20 - | 4 | 1 | SX1013 | Janetka, J. W.; Satyshur, K. A.; Rich, D. H. | A Cyclic Side-Chain-Linked Biphenyl Ether Tripeptide: H~3~N^+^-<i>cyclo</i>-[Phe^(4{-^<i>O</i>)}-Phe-Phe^(3{-^<i>O</i>)}]-OMe.Cl^{-^} | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3112 | 3114 | 10.1107/S0108270196009262 | 0.71073 | MoKα | 0.0631 | 0.0497 | null | 0.1198 | 0.1033 | null | null | null | 1.173 | 1.129 | 1.129 | null | null | null | has coordinates | Janetka, J. W.; Satyshur, K. A.; Rich, D. H.
A Cyclic Side-Chain-Linked Biphenyl Ether Tripeptide: H~3~N^+^-<i>cyclo</i>-[Phe^(4{-^<i>O</i>)}-Phe-Phe^(3{-^<i>O</i>)}]-OMe.Cl^{-^}
Acta Crystallographica Section C
52(12)
(1996)
3112-3114 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-10-13 03:08:28 +0300 (Fri, 13 Oct 2017) $
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2,005,824 | 5.188 | 0.001 | 38.076 | 0.007 | 9.049 | 0.001 | 90 | null | 96.32 | 0.01 | 90 | null | 1,776.7 | 0.5 | 293 | 2 | 193 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | [(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(S)-sulfinyloctane | - C18 H27 N O2 S - | - C18 H27 N O2 S - | - C72 H108 N4 O8 S4 - | 4 | 2 | SX1014 | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A. | Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3207 | 3210 | 10.1107/S0108270196009948 | 0.71073 | MoKα | 0.1846 | 0.0781 | null | 0.2351 | 0.1656 | null | null | null | 0.947 | 1.007 | 1.007 | null | null | null | has coordinates | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.
Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin
Acta Crystallographica Section C
52(12)
(1996)
3207-3210 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,825 | 4.828 | 0.001 | 34.865 | 0.006 | 5.317 | 0.001 | 90 | null | 98.93 | 0.01 | 90 | null | 884.2 | 0.3 | 193 | 2 | 193 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | [(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(R)-sulfinyloctane | - C18 H27 N O2 S - | - C18 H27 N O2 S - | - C36 H54 N2 O4 S2 - | 2 | 1 | SX1014 | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A. | Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3207 | 3210 | 10.1107/S0108270196009948 | 0.71073 | MoKα | 0.0832 | 0.0445 | null | 0.1326 | 0.1083 | null | null | null | 0.668 | 0.698 | 0.698 | null | null | null | has coordinates | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.
Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin
Acta Crystallographica Section C
52(12)
(1996)
3207-3210 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,322,128 | 10.173 | 0.004 | 13.758 | 0.006 | 16.102 | 0.003 | 90 | null | 92.86 | 0.02 | 90 | null | 2,250.8 | 1.4 | 188 | 2 | 188 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | Chromium(VI) dioxo-bis(tert-butyl, 2,5-fluoro-methyl-anilide) | - C22 H30 Cr F2 N2 O2 - | - C22 H30 Cr F2 N2 O2 - | - C88 H120 Cr4 F8 N8 O8 - | 4 | 1 | Aaron L. Odom; Daniel J. Mindiola; Christopher C. Cummins | A Nucleophilic Chromium(V) Dioxo Radical Anion | Inorganic Chemistry | 1,999 | 38 | 3290 | 3295 | 10.1021/ic981403r | 0.71073 | MoKα | 0.0509 | 0.0451 | null | 0.0978 | 0.0948 | null | null | null | 1.212 | 1.226 | 1.226 | null | null | null | has coordinates | Aaron L. Odom; Daniel J. Mindiola; Christopher C. Cummins
A Nucleophilic Chromium(V) Dioxo Radical Anion
Inorganic Chemistry
38
(1999)
3290-3295 | 301,838 | 2025-08-20 | 22:17:36 | #------------------------------------------------------------------------------
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2,005,826 | 32.492 | 0.008 | 7.756 | 0.003 | 5.817 | 0.002 | 90 | null | 90 | null | 90 | null | 1,465.9 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | 4-[(S)-(4,5-dihydro-2-phenyl-4-oxazolyl)methyl]-(S)-sulfinylphenol | - C16 H15 N O3 S - | - C16 H15 N O3 S - | - C64 H60 N4 O12 S4 - | 4 | 1 | SX1014 | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A. | Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3207 | 3210 | 10.1107/S0108270196009948 | 1.54178 | CuKα | 0.0737 | 0.0535 | null | 0.1739 | 0.1623 | null | null | null | 1.002 | 1.05 | 1.05 | null | null | null | has coordinates | Hempel, A.; Camerman, N.; Grierson, J.; Mastropaolo, D.; Camerman, A.
Stereochemistry of Chiral Sulfoxides used for the Synthesis of Antitumor Antibiotic Analogues of Sparsomycin
Acta Crystallographica Section C
52(12)
(1996)
3207-3210 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,827 | 27.031 | 0.001 | 13.838 | 0.001 | 15.286 | 0.001 | 90 | null | 123.27 | 0.01 | 90 | null | 4,780.6 | 0.7 | 295 | null | 295 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | triaquahexakis(μ~2~-acetato)μ~3~-oxocobalt(II)diiron(III) diaquo solvate | - C12 H28 Co Fe2 O18 - | - C12 Co0.999 Fe2.001 O18 - | - C96 Co7.992 Fe16.008 O144 - | 8 | 1 | TA1083 | Sato, T.; Ambe, F. | An Oxo-Centered Trinuclear Cobalt(II)–Diiron(III) Acetate–Aqua Complex | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3005 | 3007 | 10.1107/S0108270196008682 | 0.71073 | MoKα | null | 0.061 | null | null | 0.085 | null | null | null | null | 2.2 | 2.2 | null | null | null | has coordinates | Sato, T.; Ambe, F.
An Oxo-Centered Trinuclear Cobalt(II)–Diiron(III) Acetate–Aqua Complex
Acta Crystallographica Section C
52(12)
(1996)
3005-3007 | 277,834 | 2022-09-14 | 16:39:43 | #------------------------------------------------------------------------------
#$Date: 2022-09-14 19:38:48 +0300 (Wed, 14 Sep 2022) $
#$Revision: 277834 $
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2,005,828 | 6.853 | 0.002 | 17.675 | 0.002 | 10.203 | 0.002 | 90 | null | 92.37 | 0.02 | 90 | null | 1,234.8 | 0.5 | 213 | 1 | 213 | 1 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C16 H11 N O2 - | - C16 H11 N O2 - | - C64 H44 N4 O8 - | 4 | 1 | TA1091 | Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G. | (<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3222 | 3224 | 10.1107/S0108270196009845 | 1.5418 | CuKα | null | 0.0358 | null | null | 0.0386 | null | null | null | null | 2.857 | 2.857 | null | null | null | has coordinates | Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G.
(<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene
Acta Crystallographica Section C
52(12)
(1996)
3222-3224 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,005,829 | 10.027 | 0.001 | 11.037 | 0.002 | 12.472 | 0.001 | 90 | null | 112.015 | 0.009 | 90 | null | 1,279.6 | 0.3 | 296 | 1 | 296 | 1 | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | - C16 H11 N O2 - | - C16 H11 N O2 - | - C64 H44 N4 O8 - | 4 | 1 | TA1091 | Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G. | (<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3222 | 3224 | 10.1107/S0108270196009845 | 1.5418 | CuKα | null | 0.0377 | null | null | 0.04 | null | null | null | null | 2.876 | 2.876 | null | null | null | has coordinates | Hockless, D. C. R.; Whittall, I. R.; Humphrey, M. G.
(<i>E</i>)- and (<i>Z</i>)-4-Ethynyl-4'-nitrostilbene
Acta Crystallographica Section C
52(12)
(1996)
3222-3224 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,005,830 | 5.309 | 0.005 | 10.548 | 0.004 | 12.514 | 0.004 | 104.55 | 0.003 | 95.6 | 0.005 | 103.43 | 0.005 | 650.6 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | N-(tert-Butoxycarbonyl)-2-phenylglycine | - C13 H17 N O4 - | - C13 H17 N O4 - | - C26 H34 N2 O8 - | 2 | 1 | TA1093 | González-Cameno, A. M.; Badía, D.; Domínguez, E.; Arriortua, M. I.; Urtiaga, M. K.; Solans, X. | <i>N</i>-(<i>tert</i>-Butoxycarbonyl)-2-phenylglycine | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3169 | 3171 | 10.1107/S0108270196009857 | 0.71069 | MoKα | 0.1159 | 0.0676 | null | 0.3275 | 0.2115 | null | null | null | 1.054 | 1.051 | 1.051 | null | null | null | has coordinates | González-Cameno, A. M.; Badía, D.; Domínguez, E.; Arriortua, M. I.; Urtiaga, M. K.; Solans, X.
<i>N</i>-(<i>tert</i>-Butoxycarbonyl)-2-phenylglycine
Acta Crystallographica Section C
52(12)
(1996)
3169-3171 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,005,831 | 13.793 | 0.007 | 8.247 | 0.004 | 13.699 | 0.007 | 90 | null | 104.52 | 0.01 | 90 | null | 1,508.5 | 1.3 | 293 | null | 293 | null | null | null | null | null | 3 | P 1 21/a 1 | -P 2yab | 14 | 3-(4'-Methoxyphenyl)-2,2,4,4-tetramethylpentane | - C16 H26 O - | - C16 H26 O - | - C64 H104 O4 - | 4 | 1 | TA1097 | Collins, D. J.; Fallon, G. D.; Jacobs, H. A. | Conformation of Crystalline 3-(4-Methoxyphenyl)-2,2,4,4-tetramethylpentane | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3232 | 3234 | 10.1107/S0108270196011031 | 1.5418 | CuKα | null | 0.066 | null | null | 0.069 | null | null | null | null | 1.72 | 1.72 | null | null | null | has coordinates | Collins, D. J.; Fallon, G. D.; Jacobs, H. A.
Conformation of Crystalline 3-(4-Methoxyphenyl)-2,2,4,4-tetramethylpentane
Acta Crystallographica Section C
52(12)
(1996)
3232-3234 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,832 | 12.603 | 0.003 | 9.52 | 0.001 | 14.762 | 0.005 | 90 | 0.02 | 107.81 | 0.02 | 90 | 0.01 | 1,686.3 | 0.7 | 130 | 0.1 | 130 | 0.1 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | (1) trans-4-tert-butylcyclohexyl p-nitrobenzenesulfonate | - C16 H23 N O5 S - | - C16 H23 N O5 S - | - C64 H92 N4 O20 S4 - | 4 | 1 | TA1099 | White, J. M.; Giordano, J.; Green, A. J. | <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3204 | 3207 | 10.1107/S0108270196009912 | 0.71069 | MoKα | 0.0449 | 0.0379 | null | 0.1064 | 0.0998 | null | null | null | 1.041 | 1.055 | 1.055 | null | null | null | has coordinates | White, J. M.; Giordano, J.; Green, A. J.
<i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K
Acta Crystallographica Section C
52(12)
(1996)
3204-3207 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,005,833 | 6.612 | 0.002 | 9.333 | 0.002 | 13.819 | 0.003 | 90 | 0.02 | 96.72 | 0.03 | 90 | 0.02 | 846.9 | 0.4 | 130 | 0.1 | 130 | 0.1 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | (2) cis-4-tert-butylcyclohexyl p-nitrobenzenesulfonate | - C16 H23 N O5 S - | - C16 H23 N O5 S - | - C32 H46 N2 O10 S2 - | 2 | 1 | TA1099 | White, J. M.; Giordano, J.; Green, A. J. | <i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3204 | 3207 | 10.1107/S0108270196009912 | 1.5418 | CuKα(nickelfiltered) | 0.0479 | 0.0408 | null | 0.1755 | 0.1175 | null | null | null | 0.837 | 0.833 | 0.833 | null | null | null | has coordinates | White, J. M.; Giordano, J.; Green, A. J.
<i>cis</i>- and <i>trans</i>-4-<i>tert</i>-Butylcyclohexyl <i>p</i>-Nitrobenzenesulfonate at 130K
Acta Crystallographica Section C
52(12)
(1996)
3204-3207 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,834 | 13.791 | 0.002 | 13.791 | 0.002 | 20.313 | 0.004 | 90 | null | 90 | null | 90 | null | 3,863.4 | 1.1 | 294 | null | 294 | null | null | null | null | null | 5 | I 41/a | I 4bw -1bw | null | - C12 H21 Cd N6 O6.5 - | - C12 H20 Cd N6 O6.5 - | - C96 H160 Cd8 N48 O52 - | 8 | null | TA1102 | Chotalia, R.; Hambley, T. W.; Ridley, D. D.; Turner, P. | A Cadmium(II) Complex of Creatinine, [Cd(C~2~H~3~O~2~)~2~(C~4~H~7~N~3~O)~2~].0.5H~2~O | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3043 | 3045 | 10.1107/S0108270196009833 | 0.7107 | MoKα | 0.0305 | 0.0305 | null | 0.0302 | 0.0302 | null | null | null | 2.798 | 2.798 | 2.798 | null | null | null | has coordinates | Chotalia, R.; Hambley, T. W.; Ridley, D. D.; Turner, P.
A Cadmium(II) Complex of Creatinine, [Cd(C~2~H~3~O~2~)~2~(C~4~H~7~N~3~O)~2~].0.5H~2~O
Acta Crystallographica Section C
52(12)
(1996)
3043-3045 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,127 | 9.525 | 0.005 | 9.071 | 0.004 | 22.841 | 0.011 | 90 | null | 95.75 | 0.04 | 90 | null | 1,963.6 | 1.7 | 203 | 2 | 203 | 2 | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | - C42 H46 Fe2 N4 S4 - | - C42 H46 Fe2 N4 S4 - | - C84 H92 Fe4 N8 S8 - | 2 | 0.5 | Peter Comba; Jürgen Ensling; Philipp Gütlich; Andreas Kühner; Alexander Peters; Hans Pritzkow | Bis-macrocyclic Ligands with Two Ferrocenyl End Groups, and Their Tetranuclear Dicopper(I) Compounds | Inorganic Chemistry | 1,999 | 38 | 3316 | 3320 | 10.1021/ic981389i | 0.7107 | MoKα | 0.1103 | 0.0497 | null | null | 0.0992 | 0.1163 | null | null | null | null | null | 1.012 | null | null | has coordinates | Peter Comba; Jürgen Ensling; Philipp Gütlich; Andreas Kühner; Alexander Peters; Hans Pritzkow
Bis-macrocyclic Ligands with Two Ferrocenyl End Groups, and Their Tetranuclear Dicopper(I) Compounds
Inorganic Chemistry
38
(1999)
3316-3320 | 211,332 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,835 | 7.7523 | 0.0007 | 9.3535 | 0.0007 | 6.8139 | 0.0006 | 95.432 | 0.008 | 111.021 | 0.007 | 99.112 | 0.008 | 449.19 | 0.07 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P -1 | -P 1 | 2 | Diethyl 3,4-di(ethoxycarbonyl)-(2Z,4Z)-hexa-2,4-diene-1,6-dioate | - C16 H22 O8 - | - C16 H22 O8 - | - C16 H22 O8 - | 1 | 0.5 | TA1105 | Tani, K.; Yamagata, T.; Kataoka, Y. | Tetraethyl (1<i>Z</i>,3<i>Z</i>)-Buta-1,3-diene-1,2,3,4-tetracarboxylate | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3138 | 3140 | 10.1107/S0108270196009195 | 1.54178 | CuKα | null | 0.0668 | null | null | 0.0558 | null | null | null | null | 1.99 | 1.99 | null | null | null | has coordinates | Tani, K.; Yamagata, T.; Kataoka, Y.
Tetraethyl (1<i>Z</i>,3<i>Z</i>)-Buta-1,3-diene-1,2,3,4-tetracarboxylate
Acta Crystallographica Section C
52(12)
(1996)
3138-3140 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,836 | 7.97 | 0.002 | 14.544 | 0.003 | 16.502 | 0.004 | 90 | null | 100.58 | 0.05 | 90 | null | 1,880.3 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 1,2-di(o-methyl-phenyl)-3,3-(oxydiethyl)-guanidine hydrochloride monohydrate | - C19 H26 Cl N3 O2 - | - C19 H26 Cl N3 O2 - | - C76 H104 Cl4 N12 O8 - | 4 | 1 | TA1111 | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N. | 3,3-(Oxydiethyl)-1,2-di(<i>o</i>-methylphenyl)guanidinium Chloride Monohydrate | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3238 | 3240 | 10.1107/S0108270196011274 | 1.54176 | CuKα | 0.041 | 0.0389 | null | 0.1118 | 0.111 | null | null | null | 1.036 | 1.058 | 1.058 | null | null | null | has coordinates | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.
3,3-(Oxydiethyl)-1,2-di(<i>o</i>-methylphenyl)guanidinium Chloride Monohydrate
Acta Crystallographica Section C
52(12)
(1996)
3238-3240 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,837 | 12.661 | 0.003 | 7.216 | 0.001 | 14.796 | 0.002 | 90 | null | 105.44 | 0.02 | 90 | null | 1,303 | 0.4 | 296.2 | null | 296.2 | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C11 H9 Cl2 N O6 - | - C11 H9 Cl2 N O6 - | - C44 H36 Cl8 N4 O24 - | 4 | 1 | TA1112 | Huang, S. D.; Cox, O.; Cordero, M.; Piñeiro, S. | α,α-Diacetoxy-2,4-dichloro-5-nitrobenzaldehyde | Acta Crystallographica Section C | 1,996 | 52 | 12 | 3116 | 3118 | 10.1107/S010827019601102X | 0.7107 | MoKα | null | 0.0571 | null | null | 0.0665 | null | null | null | null | 2.63 | 2.63 | null | null | null | has coordinates | Huang, S. D.; Cox, O.; Cordero, M.; Piñeiro, S.
α,α-Diacetoxy-2,4-dichloro-5-nitrobenzaldehyde
Acta Crystallographica Section C
52(12)
(1996)
3116-3118 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,838 | 14.852 | 0.001 | 9.91 | 0.001 | 13.036 | 0.002 | 90 | null | 113.749 | 0.008 | 90 | null | 1,756.2 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | - C7 H9 N4 O2.5 - | - C7 H9 N4 O2.5 - | - C56 H72 N32 O20 - | 8 | 1 | AB1405 | Gallardo, H.; Begnini, I. M.; Vencato, I. | 5-(4-Hydroxyphenyl)tetrazole–Water (2/3) | Acta Crystallographica Section C | 1,997 | 53 | 1 | 143 | 144 | 10.1107/S0108270196012474 | 0.71073 | MoKα | 0.0453 | 0.0335 | null | 0.1055 | 0.0916 | null | null | null | 1.067 | 1.031 | 1.031 | null | null | null | has coordinates | Gallardo, H.; Begnini, I. M.; Vencato, I.
5-(4-Hydroxyphenyl)tetrazole–Water (2/3)
Acta Crystallographica Section C
53(1)
(1997)
143-144 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,839 | 5.644 | 0.002 | 13.624 | 0.002 | 22.617 | 0.001 | 90 | null | 95.31 | 0.01 | 90 | null | 1,731.6 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | 6-Oxo-6-phenyl-6-phospha-3,9-dithiabicyclo[9,4,0]pentadeca-1(11),12,14-triene | - C18 H21 O P S2 - | - C18 H21 O P S2 - | - C72 H84 O4 P4 S8 - | 4 | 1 | AB1413 | Kivekäs, R.; Muñoz, J. A.; Escriche, L.; Casabó, J.; Sillanpää, R. | 6-Oxo-6-phenyl-6-phospha-3,9-dithiabicyclo[9.4.0]pentadeca-1(11),12,14-triene | Acta Crystallographica Section C | 1,997 | 53 | 1 | 126 | 128 | 10.1107/S0108270196012140 | 0.71069 | MoKα | 0.0992 | 0.0425 | null | 0.162 | 0.0872 | null | null | null | 1.041 | 1.08 | 1.08 | null | null | null | has coordinates | Kivekäs, R.; Muñoz, J. A.; Escriche, L.; Casabó, J.; Sillanpää, R.
6-Oxo-6-phenyl-6-phospha-3,9-dithiabicyclo[9.4.0]pentadeca-1(11),12,14-triene
Acta Crystallographica Section C
53(1)
(1997)
126-128 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,840 | 5.223 | 0.0007 | 38.371 | 0.005 | 9.417 | 0.001 | 90 | null | 96.98 | 0.01 | 90 | null | 1,873.3 | 0.4 | 298 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 40<[OS(2,5)1,3,4-thiadiazolo,S]~4~-coronand-16> | 10,11,21,22,32,33,43,44-octaaza-5,16,27,38-tetraoxa-2,8,13,19,24,30,35,41,45,46,47,48-dodecathiapentacyclo[40.2.1.1^9,12^.1^20,23^.1^31,34^]octatetracontane | - C24 H32 N8 O4 S12 - | - C24 H32 N8 O4 S12 - | - C48 H64 N16 O8 S24 - | 2 | 0.5 | BK1223 | Rugutt, J. K.; Fronczek, F. R.; Watkins, S. F.; Pappalardo, S. | A Tetrameric Macrocycle with 2,5-Dithio-1,3,4-thiadiazole Subunits | Acta Crystallographica Section C | 1,997 | 53 | 1 | 81 | 84 | 10.1107/S010827019601236X | 1.54184 | CuKα | null | 0.047 | null | null | 0.062 | null | null | null | null | 1.731 | 1.731 | null | null | null | has coordinates | Rugutt, J. K.; Fronczek, F. R.; Watkins, S. F.; Pappalardo, S.
A Tetrameric Macrocycle with 2,5-Dithio-1,3,4-thiadiazole Subunits
Acta Crystallographica Section C
53(1)
(1997)
81-84 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,841 | 18.8917 | 0.0008 | 4.6858 | 0.0003 | 12.7916 | 0.0008 | 90 | null | 127.95 | 0.01 | 90 | null | 892.91 | 0.15 | 298 | null | null | null | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | 15 | - C8 H10 Br2 - | - C8 H10 Br2 - | - C32 H40 Br8 - | 4 | 0.5 | BK1224 | Dávila, A.; McLaughlin, M. L.; Fronczek, F. R.; Watkins, S. F. | 1,5-Dibromocycloocta-1,5-diene | Acta Crystallographica Section C | 1,997 | 53 | 1 | 84 | 86 | 10.1107/S0108270196012322 | 0.71073 | MoKα | null | 0.069 | null | null | 0.038 | null | null | null | null | 1.128 | 1.128 | null | null | null | has coordinates | Dávila, A.; McLaughlin, M. L.; Fronczek, F. R.; Watkins, S. F.
1,5-Dibromocycloocta-1,5-diene
Acta Crystallographica Section C
53(1)
(1997)
84-86 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,842 | 9.3811 | 0.0011 | 13.2775 | 0.0012 | 10.487 | 0.001 | 90 | null | 98.177 | 0.009 | 90 | null | 1,293 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | tricarbonyl(2-methoxycyclohexadienyl)-iron(II)-tatrafluoroborate | - C10 H9 B F4 Fe O4 - | - C10 H9 B F4 Fe O4 - | - C40 H36 B4 F16 Fe4 O16 - | 4 | 1 | BK1242 | DeBord, J. R. D.; George, T. A.; Ross, II, C. R.; Stezowski, J. J. | Tetrafluoroborate Salt of Tricarbonyl(2-methoxy-η^5^-cyclohexadienyl)iron(II) | Acta Crystallographica Section C | 1,997 | 53 | 1 | 45 | 47 | 10.1107/S0108270196011584 | 0.71073 | MoKα | 0.1174 | 0.067 | null | 0.15 | 0.1174 | null | null | null | 1.08 | 1.144 | 1.144 | null | null | null | has coordinates | DeBord, J. R. D.; George, T. A.; Ross, II, C. R.; Stezowski, J. J.
Tetrafluoroborate Salt of Tricarbonyl(2-methoxy-η^5^-cyclohexadienyl)iron(II)
Acta Crystallographica Section C
53(1)
(1997)
45-47 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,843 | 3.897 | 0.003 | 9.355 | 0.002 | 28.98 | 0.003 | 90 | null | 90.79 | 0.04 | 90 | null | 1,056.4 | 0.9 | 296 | null | 296 | null | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | anthracene-9-carboxylic acid | anthracene-9-carboxylic acid | - C15 H10 O2 - | - C15 H10 O2 - | - C60 H40 O8 - | 4 | 1 | BK1282 | Fitzgerald, L. J.; Gerkin, R. E. | Anthracene-9-carboxylic Acid | Acta Crystallographica Section C | 1,997 | 53 | 1 | 71 | 73 | 10.1107/S0108270196011213 | 0.71073 | MoKα | null | 0.044 | null | null | 0.049 | null | null | null | null | 1.6 | 1.6 | null | null | null | has coordinates | Fitzgerald, L. J.; Gerkin, R. E.
Anthracene-9-carboxylic Acid
Acta Crystallographica Section C
53(1)
(1997)
71-73 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,844 | 7.956 | 0.002 | 8.193 | 0.002 | 9.313 | 0.002 | 89.89 | 0.01 | 94.79 | 0.01 | 90.95 | 0.01 | 604.9 | 0.2 | 294 | null | 294 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | - C14 H13 N3 - | - C14 H13 N3 - | - C28 H26 N6 - | 2 | 1 | BM1071 | Mefetah, H.; Giorgi, M.; Brouant, P. | 2-Anilino-4,6-dimethylpyridine-3-carbonitrile, an Intermediate in the Synthesis of 5-Aminobenzo[<i>b</i>][1,8]naphthyridines | Acta Crystallographica Section C | 1,997 | 53 | 1 | 101 | 102 | 10.1107/S0108270196005276 | 0.71073 | MoKα | 0.239 | 0.047 | null | null | 0.054 | null | null | null | null | 1.613 | 1.613 | null | null | null | has coordinates | Mefetah, H.; Giorgi, M.; Brouant, P.
2-Anilino-4,6-dimethylpyridine-3-carbonitrile, an Intermediate in the Synthesis of 5-Aminobenzo[<i>b</i>][1,8]naphthyridines
Acta Crystallographica Section C
53(1)
(1997)
101-102 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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4,322,126 | 8.7246 | 0.0004 | 9.786 | 0.0003 | 11.1103 | 0.0004 | 90 | null | 90 | null | 90 | null | 948.59 | 0.06 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | A m a 2 | A 2 -2a | 40 | - H6 Hg I3 N O - | - Hg I3 N O - | - Hg4 I12 N4 O4 - | 4 | 0.5 | Per H. Svensson; Lars Kloo | Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions | Inorganic Chemistry | 1,999 | 38 | 3390 | 3393 | 10.1021/ic981348m | 0.71073 | MoKα | 0.043 | 0.0397 | null | 0.0914 | 0.0902 | null | null | null | 1.087 | 1.114 | 1.114 | null | null | null | has coordinates | Per H. Svensson; Lars Kloo
Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions
Inorganic Chemistry
38
(1999)
3390-3393 | 179,324 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,845 | 21.454 | 0.004 | 9.107 | 0.002 | 17.364 | 0.003 | 90 | null | 93.57 | 0.03 | 90 | null | 3,386 | 1.1 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | tetramethylammonium sodium nitroprusside 2.5-hydrate | tetramethylammonium sodium nitrosylpentacyanoferrate (II) 2.5-hydrate | - C9 H17 Fe N7 Na O3.5 - | - C9 H17 Fe N7 Na O3.5 - | - C72 H136 Fe8 N56 Na8 O28 - | 8 | 1 | BM1089 | Longridge, J. J.; Rawson, J. M.; Davies, J. E. | A Mixed Cation Ternary Nitroprusside: [(CH~3~)~4~N][Na][Fe(CN)~5~(NO)].2.5H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 15 | 17 | 10.1107/S0108270196011468 | 0.71073 | MoKα | 0.066 | 0.0477 | null | 0.1259 | 0.1155 | null | null | null | 1.086 | 1.14 | 1.14 | null | null | null | has coordinates,has disorder | Longridge, J. J.; Rawson, J. M.; Davies, J. E.
A Mixed Cation Ternary Nitroprusside: [(CH~3~)~4~N][Na][Fe(CN)~5~(NO)].2.5H~2~O
Acta Crystallographica Section C
53(1)
(1997)
15-17 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,846 | 16.088 | 0.002 | 16.088 | 0.002 | 5.197 | 0.001 | 90 | null | 90 | null | 120 | null | 1,164.9 | 0.3 | 120 | 1 | 120 | 1 | null | null | null | null | 3 | R -3 :H | -R 3 | 148 | hexakis[mercaptomethyl]benzene | - C12 H18 S6 - | - C12 H18 S6 - | - C36 H54 S18 - | 3 | 0.166667 | BM1105 | Mallinson, P. R.; MacNicol, D. D.; McCormack, K. L.; Yufit, D. S.; Gall, J. H.; Henderson, R. K. | Hexakis(mercaptomethyl)benzene: a Structure Possessing Well Ordered Homodromic [SH···S]~6~ Interactions | Acta Crystallographica Section C | 1,997 | 53 | 1 | 90 | 92 | 10.1107/S0108270196010499 | 0.71073 | MoKα | 0.1663 | 0.0554 | null | 0.123 | 0.104 | null | null | null | 0.847 | 1.076 | 1.076 | null | null | null | has coordinates | Mallinson, P. R.; MacNicol, D. D.; McCormack, K. L.; Yufit, D. S.; Gall, J. H.; Henderson, R. K.
Hexakis(mercaptomethyl)benzene: a Structure Possessing Well Ordered Homodromic [SH···S]~6~ Interactions
Acta Crystallographica Section C
53(1)
(1997)
90-92 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,847 | 13.62 | 0.005 | 12.088 | 0.005 | 4.115 | 0.002 | 90 | null | 90 | null | 90 | null | 677.5 | 0.5 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 21 21 2 | P 2 2ab | 18 | Bis(2-nitrophenyl)trisulphide | - C12 H8 N2 O4 S3 - | - C12 H8 N2 O4 S3 - | - C24 H16 N4 O8 S6 - | 2 | 0.5 | BM1114 | Cox, P. J.; Wardell, J. L. | A Polymorph of Bis(2-nitrophenyl) Trisulfide | Acta Crystallographica Section C | 1,997 | 53 | 1 | 122 | 124 | 10.1107/S0108270196012838 | 0.71069 | MoKα | 0.0496 | 0.0478 | null | 0.1105 | 0.1098 | null | null | null | 1.089 | 1.129 | 1.129 | null | null | null | has coordinates | Cox, P. J.; Wardell, J. L.
A Polymorph of Bis(2-nitrophenyl) Trisulfide
Acta Crystallographica Section C
53(1)
(1997)
122-124 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,848 | 21.393 | 0.004 | 11.586 | 0.002 | 22.635 | 0.005 | 90 | null | 90.09 | 0.03 | 90 | null | 5,610.3 | 1.9 | 150 | 2 | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | - C46 H72 Cr2 N4 Na2 O22 - | - C46 H72 Cr2 N4 Na2 O22 - | - C184 H288 Cr8 N16 Na8 O88 - | 4 | 0.5 | BR1160 | Borrmann, H.; Pirani, A. M.; Schrobilgen, G. J. | [2,2,2-Crypt-Na]~2~[Cr~2~(CO)~10~]: a Chromium(‒1) Carbonyl Structure with a Very Weakly Coordinating Cation | Acta Crystallographica Section C | 1,997 | 53 | 1 | 19 | 22 | 10.1107/S0108270196011390 | 0.71073 | MoKα | 0.0486 | null | null | 0.0977 | 0.0879 | null | null | null | 1.048 | 1.085 | 1.085 | null | null | null | has coordinates | Borrmann, H.; Pirani, A. M.; Schrobilgen, G. J.
[2,2,2-Crypt-Na]~2~[Cr~2~(CO)~10~]: a Chromium(‒1) Carbonyl Structure with a Very Weakly Coordinating Cation
Acta Crystallographica Section C
53(1)
(1997)
19-22 | 198,515 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,849 | 16.505 | 0.004 | 11.657 | 0.003 | 21.918 | 0.006 | 90 | null | 99.79 | 0.02 | 90 | null | 4,155.6 | 1.9 | 178 | 2 | 178 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | {trans-(2,2,4,4-tetrafluoro-1,3-di-t-butyl-1,3-diphosphetane)}- pentacarbonyltungsten(0) | - C15 H18 F4 O5 P2 W - | - C15 H18 F4 O5 P2 W - | - C120 H144 F32 O40 P16 W8 - | 8 | 2 | BS1001 | Jones, P. G.; Thöne, C. | Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane | Acta Crystallographica Section C | 1,997 | 53 | 1 | 42 | 45 | 10.1107/S0108270196011870 | 0.71073 | MoKα | 0.056 | 0.0306 | null | 0.0786 | 0.0677 | null | null | null | 0.993 | 1.037 | 1.037 | null | null | null | has coordinates | Jones, P. G.; Thöne, C.
Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane
Acta Crystallographica Section C
53(1)
(1997)
42-45 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,850 | 19.99 | 0.006 | 7.096 | 0.003 | 8.606 | 0.003 | 90 | null | 92.48 | 0.03 | 90 | null | 1,219.6 | 0.8 | 178 | 2 | 178 | 2 | null | null | null | null | 6 | C 1 2/m 1 | -C 2y | 12 | {trans-(2,2,4,4-tetrafluoro-1,3-di-t-butyl-1,3-diphosphetane)}- bis(chlorogold(I)) bis-dichloromethane solvate | - C12 H22 Au2 Cl6 F4 P2 - | - C12 H22 Au2 Cl6 F4 P2 - | - C24 H44 Au4 Cl12 F8 P4 - | 2 | 0.25 | BS1001 | Jones, P. G.; Thöne, C. | Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane | Acta Crystallographica Section C | 1,997 | 53 | 1 | 42 | 45 | 10.1107/S0108270196011870 | 0.71073 | MoKα | 0.04 | 0.0268 | null | 0.0618 | 0.0567 | null | null | null | 1.045 | 1.057 | 1.057 | null | null | null | has coordinates | Jones, P. G.; Thöne, C.
Metal Complexes of <i>trans</i>-2,2,4,4-Tetrafluoro-1,3-di-<i>tert</i>-butyl-1,3-diphosphetane
Acta Crystallographica Section C
53(1)
(1997)
42-45 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,851 | 11.368 | 0.002 | 13.49 | 0.003 | 13.573 | 0.003 | 61.62 | 0.03 | 84.55 | 0.03 | 87.83 | 0.03 | 1,823 | 0.8 | 223 | 2 | 223 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | Bis (bistriphenylphosphineimine) hexamolybdate | - C72 H60 Mo6 N2 O19 P4 - | - C72 H60 Mo6 N2 O19 P4 - | - C72 H60 Mo6 N2 O19 P4 - | 1 | 0.5 | BS1007 | Hoppe, S.; Stark, J. L.; Whitmire, K. H. | Bis[bis(triphenylphosphine)iminium] Hexamolybdate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 68 | 70 | 10.1107/S0108270196011791 | 0.71073 | MoKα | 0.0713 | 0.0471 | null | 0.1228 | 0.1086 | null | null | null | 1.046 | 1.078 | 1.078 | null | null | null | has coordinates | Hoppe, S.; Stark, J. L.; Whitmire, K. H.
Bis[bis(triphenylphosphine)iminium] Hexamolybdate
Acta Crystallographica Section C
53(1)
(1997)
68-70 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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4,322,125 | 14.275 | 0.003 | 19.721 | 0.004 | 10.416 | 0.002 | 90 | null | 90 | null | 90 | null | 2,932.3 | 1 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P b a m | -P 2 2ab | 55 | - C12 H26 Hg2 I7 N8 - | - C12 H26 Hg2.01 I7 N8 - | - C48 H104 Hg8.04 I28 N32 - | 4 | 0.5 | Per H. Svensson; Lars Kloo | Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions | Inorganic Chemistry | 1,999 | 38 | 3390 | 3393 | 10.1021/ic981348m | 0.71073 | MoKα | 0.0463 | 0.0357 | null | 0.0813 | 0.0775 | null | null | null | 1.069 | 1.131 | 1.131 | null | null | null | has coordinates | Per H. Svensson; Lars Kloo
Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions
Inorganic Chemistry
38
(1999)
3390-3393 | 179,324 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,852 | 9.217 | 0.003 | 24.675 | 0.005 | 15.698 | 0.004 | 90 | null | 102.89 | 0.02 | 90 | null | 3,480.2 | 1.6 | 300 | null | 300 | null | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | di-μ-thio-bis[chloro(oxo)bis(pyridine)molybdenum](Mo-Mo) | - C30 H30 Cl2 Mo2 N6 O2 S2 - | - C30 Cl2 Mo2 N6 O2 S2 - | - C120 Cl8 Mo8 N24 O8 S8 - | 4 | 1 | CF1119 | Mizutani, J.; Imoto, H.; Saito, T. | A Dinuclear Molybdenum Complex: [{MoClO(pyridine)~2~}~2~(μ-S)~2~].2C~5~H~5~N | Acta Crystallographica Section C | 1,997 | 53 | 1 | 47 | 50 | 10.1107/S0108270196010116 | 0.7107 | MoKα | null | 0.0633 | null | null | 0.0384 | null | null | null | null | 2.65 | 2.65 | null | null | null | has coordinates | Mizutani, J.; Imoto, H.; Saito, T.
A Dinuclear Molybdenum Complex: [{MoClO(pyridine)~2~}~2~(μ-S)~2~].2C~5~H~5~N
Acta Crystallographica Section C
53(1)
(1997)
47-50 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,853 | 10.241 | 0.004 | 8.649 | 0.003 | 13.848 | 0.005 | 90 | null | 109.93 | 0.03 | 90 | null | 1,153.2 | 0.7 | 293 | 2 | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | 15 | - As4 In2 Na2 O14 - | - As4 In2 Na2 O14 - | - As16 In8 Na8 O56 - | 4 | 0.5 | NaInAs~2~O~7~ | Acta Crystallographica C | 1,997 | 53 | 05 | 07 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates |
NaInAs~2~O~7~
Acta Crystallographica C
53
(1997)
05-07 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,854 | 8.789 | 0.004 | 17.3 | 0.007 | 8.595 | 0.003 | 90 | null | 90 | null | 90 | null | 1,306.9 | 0.9 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P n a 21 | P 2c -2n | 33 | aluminum potassium phospho-arsenate | - Al2 As1.92 K3 O12 P1.08 - | - Al2 As1.925 K3 O12 P1.075 - | - Al8 As7.7 K12 O48 P4.3 - | 4 | 1 | DU1164 | Boughzala, H.; Driss, A.; Jouini, T. | K~3~Al~2~As~1,92~P~1,08~O~12~ | Acta Crystallographica Section C | 1,997 | 53 | 1 | 3 | 5 | 10.1107/S0108270196009894 | 0.71069 | MoKα | 0.0923 | 0.0493 | null | 0.0609 | 0.0537 | null | null | null | 1.318 | 1.462 | 1.462 | null | null | null | has coordinates | Boughzala, H.; Driss, A.; Jouini, T.
K~3~Al~2~As~1,92~P~1,08~O~12~
Acta Crystallographica Section C
53(1)
(1997)
3-5 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,855 | 33.775 | 0.006 | 9.5143 | 0.0011 | 14.987 | 0.003 | 90 | null | 105.433 | 0.014 | 90 | null | 4,642.4 | 1.4 | 294 | null | 294 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Di(hydridotetracarbonylosmium)diphenylgermane | - C20 H12 Ge O8 Os2 - | - C20 H12 Ge O8 Os2 - | - C160 H96 Ge8 O64 Os16 - | 8 | 1 | FG1150 | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K. | Bisphenylbis[tetracarbonyl(hydrido)osmio]germane, Ph~2~Ge[Os(CO)~4~H]~2~ | Acta Crystallographica Section C | 1,997 | 53 | 1 | 22 | 24 | 10.1107/S0108270196012061 | 0.7093 | MoKα | null | 0.045 | null | null | 0.055 | null | null | null | null | 3 | 3 | null | null | null | has coordinates | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.
Bisphenylbis[tetracarbonyl(hydrido)osmio]germane, Ph~2~Ge[Os(CO)~4~H]~2~
Acta Crystallographica Section C
53(1)
(1997)
22-24 | 192,299 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,856 | 9.5247 | 0.0008 | 16.7749 | 0.0018 | 12.9718 | 0.0019 | 90 | null | 97.574 | 0.009 | 90 | null | 2,054.5 | 0.4 | 294 | null | 294 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | (mu-chloro)tri(mu-hydrido)dodecacarbonyltetraosmium | - C12 H3 Cl O12 Os4 - | - C12 H3 Cl O12 Os4 - | - C48 H12 Cl4 O48 Os16 - | 4 | 1 | FG1152 | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K. | Two Chloro-Bridged Osmium Clusters | Acta Crystallographica Section C | 1,997 | 53 | 1 | 24 | 27 | 10.1107/S0108270196012073 | 0.7093 | MolybdenumKα | 0.038 | 0.038 | null | 0.041 | 0.041 | null | null | null | null | 3.2 | 3.2 | null | null | null | has coordinates | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.
Two Chloro-Bridged Osmium Clusters
Acta Crystallographica Section C
53(1)
(1997)
24-27 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,857 | 8.8621 | 0.0015 | 9.3825 | 0.0015 | 15.9148 | 0.0023 | 80.815 | 0.013 | 85.332 | 0.013 | 62.828 | 0.013 | 1,162.1 | 0.3 | 294 | null | 294 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | (mu-chloro)tri(mu-hydrido)tetradecacarbonylpentaosmium | - C14 H3 Cl O14 Os5 - | - C14 H3 Cl O14 Os5 - | - C28 H6 Cl2 O28 Os10 - | 2 | 1 | FG1152 | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K. | Two Chloro-Bridged Osmium Clusters | Acta Crystallographica Section C | 1,997 | 53 | 1 | 24 | 27 | 10.1107/S0108270196012073 | 0.7093 | MolybdenumKα | 0.054 | 0.054 | null | 0.063 | 0.063 | null | null | null | null | 3.2 | 3.2 | null | null | null | has coordinates | Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.
Two Chloro-Bridged Osmium Clusters
Acta Crystallographica Section C
53(1)
(1997)
24-27 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,858 | 9.493 | 0.001 | 11.426 | 0.001 | 14.932 | 0.002 | 90 | null | 102.77 | 0.01 | 90 | null | 1,579.6 | 0.3 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | 5-Deoxy-1,2-O-isopropylidene-5-C-(5-carboethoxy-1,2,3-triazol-1-yl)- α-D-xylofuranose | - C13 H19 N3 O6 - | - C13 H19 N3 O6 - | - C52 H76 N12 O24 - | 4 | 2 | FG1203 | Horton, D.; Levine, B. R.; Norris, P.; Luck, R. L.; Silverton, J. V. | 5-Deoxy-5-<i>C</i>-(5-ethoxycarbonyl-1,2,3-triazol-1-yl)-1,2-<i>O</i>-isopropylidene-α-<small>D</small>-xylofuranose | Acta Crystallographica Section C | 1,997 | 53 | 1 | 120 | 122 | 10.1107/S0108270196012097 | 1.54184 | copperKα | null | 0.052 | null | null | 0.06 | null | null | null | null | 2.19 | 2.19 | null | null | null | has coordinates | Horton, D.; Levine, B. R.; Norris, P.; Luck, R. L.; Silverton, J. V.
5-Deoxy-5-<i>C</i>-(5-ethoxycarbonyl-1,2,3-triazol-1-yl)-1,2-<i>O</i>-isopropylidene-α-<small>D</small>-xylofuranose
Acta Crystallographica Section C
53(1)
(1997)
120-122 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,859 | 4.898 | 0.001 | 12.925 | 0.002 | 13.875 | 0.001 | 90 | null | 90 | null | 90 | null | 878.4 | 0.2 | 296 | null | 296 | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | N-acetyl-L-glutamic acid | - C7 H11 N O5 - | - C7 H11 N O5 - | - C28 H44 N4 O20 - | 4 | 1 | FG1211 | Dobson, A. J.; Gerkin, R. E. | <i>N</i>-Acetyl-<small>L</small>-glutamic Acid | Acta Crystallographica Section C | 1,997 | 53 | 1 | 73 | 76 | 10.1107/S0108270196011882 | 0.71073 | MoKα | null | 0.031 | null | null | 0.039 | null | null | null | null | 1.66 | 1.66 | null | null | null | has coordinates | Dobson, A. J.; Gerkin, R. E.
<i>N</i>-Acetyl-<small>L</small>-glutamic Acid
Acta Crystallographica Section C
53(1)
(1997)
73-76 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,860 | 5.8824 | 0.0007 | 12.451 | 0.002 | 6.7557 | 0.0008 | 90 | null | 110.186 | 0.006 | 90 | null | 464.41 | 0.11 | 296 | 2 | 298 | 2 | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | (-)-cis Pinononic acid | (-)-cis-3-acetyl-2,2-dimethylcyclobutanecarboxylic acid | - C9 H14 O3 - | - C9 H14 O3 - | - C18 H28 O6 - | 2 | 1 | FG1213 | Coté, M. L.; Thompson, H. W.; Lalancette, R. A. | ({-})-<i>cis</i>-Pinononic Acid: Hydrogen-Bonding Pattern of a δ-Keto Acid | Acta Crystallographica Section C | 1,997 | 53 | 1 | 102 | 106 | 10.1107/S0108270196012103 | 0.71073 | MoKα | 0.0766 | 0.0425 | null | 0.1016 | 0.0922 | null | null | null | 0.836 | 1.033 | 1.033 | null | null | null | has coordinates,has disorder | Coté, M. L.; Thompson, H. W.; Lalancette, R. A.
({-})-<i>cis</i>-Pinononic Acid: Hydrogen-Bonding Pattern of a δ-Keto Acid
Acta Crystallographica Section C
53(1)
(1997)
102-106 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,861 | 7.6532 | 0.0015 | 7.769 | 0.002 | 12.177 | 0.002 | 90 | null | 98.228 | 0.014 | 90 | null | 716.6 | 0.3 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 1,2,4-trimethyl-1,2,4-triazolidine-3,5-dione | - C5 H9 N3 O2 - | - C5 H9 N3 O2 - | - C20 H36 N12 O8 - | 4 | 1 | FG1225 | Meyers, C. Y.; Lutfi, H. G.; Hou, Y.; Robinson, P. D. | Racemic 1,2,4-Trimethylurazole | Acta Crystallographica Section C | 1,997 | 53 | 1 | 98 | 100 | 10.1107/S0108270196011894 | 0.71069 | MoKα | null | 0.059 | null | null | 0.041 | null | null | null | null | 3.8 | 3.8 | null | null | null | has coordinates | Meyers, C. Y.; Lutfi, H. G.; Hou, Y.; Robinson, P. D.
Racemic 1,2,4-Trimethylurazole
Acta Crystallographica Section C
53(1)
(1997)
98-100 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,862 | 8.48 | 0.002 | 7.436 | 0.002 | 20.783 | 0.002 | 90 | null | 93.5 | 0.02 | 90 | null | 1,308.1 | 0.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 2-methylperimidinium acetate monohydrate | - C14 H16 N2 O3 - | - C14 H16 N2 O3 - | - C56 H64 N8 O12 - | 4 | 1 | FG1235 | Patnaik, S.; Vishnumurthy, K.; Sridhar, M.; Chandrasekhar, S.; Usha, K.; Guru Row, T. N. | 2-Methylperimidinium Acetate Monohydrate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 130 | 132 | 10.1107/S0108270196012589 | 1.5418 | CuK~α~ | 0.0753 | 0.0531 | null | 0.1656 | 0.1289 | null | null | null | 1.093 | 1.026 | 1.026 | null | null | null | has coordinates | Patnaik, S.; Vishnumurthy, K.; Sridhar, M.; Chandrasekhar, S.; Usha, K.; Guru Row, T. N.
2-Methylperimidinium Acetate Monohydrate
Acta Crystallographica Section C
53(1)
(1997)
130-132 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,863 | 5.592 | 0.0001 | 21.3403 | 0.0005 | 9.7192 | 0.0002 | 90 | null | 96.197 | 0.001 | 90 | null | 1,153.06 | 0.04 | 173 | 2 | 173 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C20 H23 N O12 - | - C20 H23 N O12 - | - C40 H46 N2 O24 - | 2 | 1 | FR1003 | Abboud, K. A.; Toporek, S. S.; Horenstein, B. A. | <i>p</i>-Nitrophenyl 2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside | Acta Crystallographica Section C | 1,997 | 53 | 1 | 118 | 120 | 10.1107/S0108270196012784 | 0.71073 | MoKα | 0.0383 | 0.0344 | null | 0.0909 | 0.0846 | null | null | null | 1.124 | 1.108 | 1.108 | null | null | null | has coordinates | Abboud, K. A.; Toporek, S. S.; Horenstein, B. A.
<i>p</i>-Nitrophenyl 2,3,4,6-Tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside
Acta Crystallographica Section C
53(1)
(1997)
118-120 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,864 | 7.046 | 0.004 | 6.287 | 0.004 | 24.486 | 0.005 | 90 | null | 90.04 | 0.04 | 90 | null | 1,084.7 | 1 | 296 | null | 296 | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C14 H28 Co N2 O12 S2 - | - C14 H28 Co N2 O12 S2 - | - C28 H56 Co2 N4 O24 S4 - | 2 | 0.5 | FR1012 | Gunderman, B. J.; Dubey, S. N.; Squattrito, P. J. | Hexaaquacobalt(II) Bis(2-aminotoluene-4-sulfonate) | Acta Crystallographica Section C | 1,997 | 53 | 1 | 17 | 19 | 10.1107/S0108270196011419 | 0.7107 | MoKα | 0.065 | 0.032 | null | 0.049 | 0.03 | null | null | null | null | 1.76 | 1.76 | null | null | null | has coordinates | Gunderman, B. J.; Dubey, S. N.; Squattrito, P. J.
Hexaaquacobalt(II) Bis(2-aminotoluene-4-sulfonate)
Acta Crystallographica Section C
53(1)
(1997)
17-19 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,865 | 11.503 | 0.002 | 18.218 | 0.005 | 9.305 | 0.002 | 90 | null | 110.359 | 0.005 | 90 | null | 1,828.2 | 0.7 | 296 | 2 | 296 | 2 | null | null | null | null | 4 | P 1 21/a 1 | -P 2yab | 14 | N,N'-Bis(1-pyrenylmethyl)-1,4,10,13-tetraoxa-7,16-diaza-cyclooctadecane | - C46 H46 N2 O4 - | - C46 H46 N2 O4 - | - C92 H92 N4 O8 - | 2 | 0.5 | HA1169 | Kubo, K.; Kato, N.; Sakurai, T. | <i>N</i>,<i>N</i>'-Bis(1-pyrenylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane | Acta Crystallographica Section C | 1,997 | 53 | 1 | 132 | 134 | 10.1107/S0108270196011808 | 1.54184 | CuKα | 0.07 | 0.0474 | null | 0.1506 | 0.1325 | null | null | null | 1.03 | 1.07 | 1.07 | null | null | null | has coordinates | Kubo, K.; Kato, N.; Sakurai, T.
<i>N</i>,<i>N</i>'-Bis(1-pyrenylmethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
Acta Crystallographica Section C
53(1)
(1997)
132-134 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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4,322,124 | 13.645 | 0.004 | 7.022 | 0.002 | 15.5 | 0.004 | 90 | null | 113.98 | 0.02 | 90 | null | 1,356.9 | 0.7 | 295 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C25 H32 N O11 V - | - C25 H32 N O11 V - | - C50 H64 N2 O22 V2 - | 2 | 1 | Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty | Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands | Inorganic Chemistry | 1,999 | 38 | 3283 | 3289 | 10.1021/ic981344h | 0.71073 | MoKα | 0.0962 | 0.063 | null | 0.1891 | 0.1375 | null | null | null | 1.03 | 1.079 | 1.079 | null | null | null | has coordinates | Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty
Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands
Inorganic Chemistry
38
(1999)
3283-3289 | 301,838 | 2025-08-20 | 22:17:36 | #------------------------------------------------------------------------------
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2,005,866 | 18.0187 | 0.002 | 13.546 | 0.004 | 18.092 | 0.003 | 90 | null | 115.389 | 0.012 | 90 | null | 3,989.4 | 1.5 | 123 | 2 | 123 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 1,5-Bis[4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinio)-1-penten-3-ylidene]- carbonohydrazide Dichloride Methanol Solvate | - C40 H62 Cl2 N6 O2 - | - C40 H62 Cl2 N6 O2 - | - C160 H248 Cl8 N24 O8 - | 4 | 1 | HA1170 | Yang, J.; Kumar, P.; Dimmock, J. R.; Quail, J. W. | 1,5-Bis[4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinio)-1-penten-3-ylidene]carbonohydrazide Dichloride Methanol Solvate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 140 | 143 | 10.1107/S0108270196012607 | 0.71073 | MolybdenumKα | 0.123 | 0.056 | null | 0.059 | 0.055 | null | null | null | null | 1.57 | 1.57 | null | null | null | has coordinates | Yang, J.; Kumar, P.; Dimmock, J. R.; Quail, J. W.
1,5-Bis[4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinio)-1-penten-3-ylidene]carbonohydrazide Dichloride Methanol Solvate
Acta Crystallographica Section C
53(1)
(1997)
140-143 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,867 | 8.23 | 0.001 | 18.205 | 0.002 | 16.384 | 0.002 | 90 | null | 99 | 0.01 | 90 | null | 2,424.5 | 0.5 | 288 | 2 | 288 | 2 | null | null | null | null | 3 | P 1 21/n 1 | -P 2yn | 14 | 1,2-dihydronaphtho[3,4-b]cyclopenteno[1,2-e]-4H-pyran-4-one | - C16 H14 O2 - | - C16 H14 O2 - | - C128 H112 O16 - | 8 | 2 | HA1171 | Cao, Z.; Cao, X.; Zhang, D.-C.; Xu, F.; Yu, K. | 1,2-Dihydronaphtho[3,4-<i>b</i>]cyclopenteno[1,2-<i>e</i>]-4<i>H</i>-pyran-4-one | Acta Crystallographica Section C | 1,997 | 53 | 1 | 144 | 146 | 10.1107/S010827019601270X | 0.71073 | MoKα | 0.0771 | 0.0377 | null | 0.1093 | 0.0818 | null | null | null | 0.85 | 1.034 | 1.034 | null | null | null | has coordinates | Cao, Z.; Cao, X.; Zhang, D.-C.; Xu, F.; Yu, K.
1,2-Dihydronaphtho[3,4-<i>b</i>]cyclopenteno[1,2-<i>e</i>]-4<i>H</i>-pyran-4-one
Acta Crystallographica Section C
53(1)
(1997)
144-146 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,868 | 6.3561 | 0.0014 | 9.892 | 0.002 | 14.937 | 0.003 | 90 | null | 95.04 | 0.02 | 90 | null | 935.5 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | 5S-3-Phenyl-5-(6'R,7R,14'R-1',8',13',16'-tetraoxadispiro[5.0.5.4] hexadecan-14'-yl)-4,5-dihydrooxisoxazole | - C21 H27 N O5 - | - C21 H27 N O5 - | - C42 H54 N2 O10 - | 2 | 1 | HA1176 | Blake, A. J.; Gould, R. O.; Paton, R. M.; Todd, C. J. | (5<i>S</i>)-3-Phenyl-5-[(6<i>R</i>,7<i>R</i>,14<i>R</i>)-1,8,13,16-tetraoxadispiro[5.0.5.4]hexadecan-14-yl]-4,5-dihydroisoxazole: the Major Adduct Resulting from Cycloaddition of Benzonitrile Oxide to (6<i>R</i>,7<i>R</i>,14<i>S</i>)-14-Vinyl-1,8,13,16-tetraoxadispiro[5.0.5.4]hexadecane | Acta Crystallographica Section C | 1,997 | 53 | 1 | 116 | 117 | 10.1107/S0108270196012243 | 0.71073 | MoKα | 0.0305 | 0.0276 | null | 0.0766 | 0.0714 | null | null | null | 1.095 | 1.096 | 1.096 | null | null | null | has coordinates | Blake, A. J.; Gould, R. O.; Paton, R. M.; Todd, C. J.
(5<i>S</i>)-3-Phenyl-5-[(6<i>R</i>,7<i>R</i>,14<i>R</i>)-1,8,13,16-tetraoxadispiro[5.0.5.4]hexadecan-14-yl]-4,5-dihydroisoxazole: the Major Adduct Resulting from Cycloaddition of Benzonitrile Oxide to (6<i>R</i>,7<i>R</i>,14<i>S</i>)-14-Vinyl-1,8,13,16-tetraoxadispi... | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,869 | 13.366 | 0.001 | 7.3869 | 0.0007 | 29.892 | 0.003 | 90 | null | 90 | null | 90 | null | 2,951.3 | 0.5 | 150 | 2 | 150 | 2 | null | null | null | null | 6 | P b c a | -P 2ac 2ab | 61 | 1-(4-bromophenyl)-2-fluoroethanone (2,4-dinitrophenyl)hydrazone | - C14 H10 Br F N4 O4 - | - C14 H10 Br F N4 O4 - | - C112 H80 Br8 F8 N32 O32 - | 8 | 1 | HA1178 | Borwick, S. J.; Howard, J. A. K.; Lehmann, C. W.; O'Hagan, D. | 1-(4-Bromophenyl)-2-fluoroethanone (2,4-Dinitrophenyl)hydrazone Containing a Particularly Short Fluorine–Hydrogen Bond | Acta Crystallographica Section C | 1,997 | 53 | 1 | 124 | 126 | 10.1107/S0108270196013133 | 0.71073 | MoKα | 0.0496 | 0.0373 | null | 0.0857 | 0.0771 | null | null | null | 1.211 | 1.215 | 1.215 | null | null | null | has coordinates | Borwick, S. J.; Howard, J. A. K.; Lehmann, C. W.; O'Hagan, D.
1-(4-Bromophenyl)-2-fluoroethanone (2,4-Dinitrophenyl)hydrazone Containing a Particularly Short Fluorine–Hydrogen Bond
Acta Crystallographica Section C
53(1)
(1997)
124-126 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,870 | 4.8781 | 0.001 | 10.475 | 0.001 | 30.2952 | 0.001 | 90 | null | 90 | null | 90 | null | 1,548 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | (Pyrazole-κN^2^)[N-salicylidene-κO-(S)-alaninato-κN,κO]copper(II) Dihydrate | - C13 H17 Cu N3 O5 - | - C13 H17 Cu N3 O5 - | - C52 H68 Cu4 N12 O20 - | 4 | 1 | JZ1116 | Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M. | (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 50 | 54 | 10.1107/S0108270196010992 | 1.54178 | CuKα | 0.0436 | 0.0423 | null | 0.1166 | 0.1152 | null | null | null | 1.037 | 1.041 | 1.041 | null | null | null | has coordinates | Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M.
(Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate... | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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4,322,123 | 13.146 | 0.007 | 15.142 | 0.005 | 25.631 | 0.009 | 90 | null | 90 | null | 90 | null | 5,102 | 4 | 295 | 2 | 295 | 2 | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | 19 | - C21 H32 N O11 V - | - C21 H32 N O11 V - | - C168 H256 N8 O88 V8 - | 8 | 2 | Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty | Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands | Inorganic Chemistry | 1,999 | 38 | 3283 | 3289 | 10.1021/ic981344h | 0.71073 | MoKα | 0.1589 | 0.0806 | null | 0.2522 | 0.1681 | null | null | null | 1.024 | 1.011 | 1.011 | null | null | null | has coordinates | Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty
Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands
Inorganic Chemistry
38
(1999)
3283-3289 | 179,324 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,871 | 10.3223 | 0.0005 | 8.3892 | 0.0003 | 19.9025 | 0.0009 | 90 | null | 97.533 | 0.004 | 90 | null | 1,708.6 | 0.13 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | (Pyrazole-κN^2^)[N-salicylidene-κO-(R,S)-alaninato-κN,κO]copper(II) Pyrazole Solvate | - C16 H17 Cu N5 O3 - | - C16 H17 Cu N5 O3 - | - C64 H68 Cu4 N20 O12 - | 4 | 1 | JZ1116 | Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M. | (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 50 | 54 | 10.1107/S0108270196010992 | 1.54178 | CuKα | 0.0686 | 0.0681 | null | 0.1833 | 0.1826 | null | null | null | 1.145 | 1.152 | 1.152 | null | null | null | has coordinates | Warda, S. A.; Friebel, C.; Sivý, J.; Plesch, G.; Bláhová, M.
(Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Dihydrate and (Pyrazole-κ<i>N</i>^2^)[<i>N</i>-salicylidene-κ<i>O</i>-(<i>R</i>,<i>S</i>)-alaninato-κ^2^<i>N</i>,<i>O</i>]copper(II) Pyrazole Solvate... | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,872 | 21.374 | 0.006 | 13.072 | 0.008 | 23.771 | 0.012 | 90 | null | 105.11 | 0.03 | 90 | null | 6,412 | 5 | 208 | 2 | 293 | 2 | null | null | null | null | 8 | P 1 21/c 1 | -P 2ybc | 14 | Di-[bis-(triphenylphosphoranylidene)-ammonium Fluoropentachloroosmate(IV) Hydrate | - C72 H62 Cl5 F N2 O Os P4 - | - C72 H62 Cl5 F N2 O Os P4 - | - C288 H248 Cl20 F4 N8 O4 Os4 P16 - | 4 | 1 | JZ1142 | Bruhn, C.; Preetz, W. | Bis[bis(triphenylphosphoranylidene)ammonium] Pentachlorofluoroosmate(IV) Hydrate, [(C~6~H~5~)~3~P= N= P(C~6~H~5~)~3~]~2~[OsFCl~5~].H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 63 | 66 | 10.1107/S010827019601061X | 0.71069 | MoKα | 0.1222 | 0.0479 | null | 0.106 | 0.076 | null | null | null | 1.162 | 1.108 | 1.108 | null | null | null | has coordinates | Bruhn, C.; Preetz, W.
Bis[bis(triphenylphosphoranylidene)ammonium] Pentachlorofluoroosmate(IV) Hydrate, [(C~6~H~5~)~3~P= N= P(C~6~H~5~)~3~]~2~[OsFCl~5~].H~2~O
Acta Crystallographica Section C
53(1)
(1997)
63-66 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,873 | 9.141 | 0.002 | 9.16 | 0.002 | 10.736 | 0.004 | 90.28 | 0.02 | 90.52 | 0.02 | 90.11 | 0.02 | 898.9 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 | P 1 | 1 | - K2 Mg O10 P2 W - | - K2 Mg O10 P2 W - | - K8 Mg4 O40 P8 W4 - | 4 | 4 | JZ1148 | Peuchert, U.; Bohatý, L.; Schreuer, J. | The Triclinic Room-Temperature Modification of K~2~MgWO~2~(PO~4~)~2~ | Acta Crystallographica Section C | 1,997 | 53 | 1 | 11 | 14 | 10.1107/S0108270196011389 | 0.71073 | MoKα | 0.0227 | 0.0213 | null | 0.0514 | 0.0507 | null | null | null | 1.067 | 1.071 | 1.071 | null | null | null | has coordinates | Peuchert, U.; Bohatý, L.; Schreuer, J.
The Triclinic Room-Temperature Modification of K~2~MgWO~2~(PO~4~)~2~
Acta Crystallographica Section C
53(1)
(1997)
11-14 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,874 | 5.377 | 0.001 | 10.488 | 0.001 | 20.32 | 0.002 | 77.41 | 0.01 | 86.14 | 0.01 | 80.28 | 0.01 | 1,101.8 | 0.3 | 295 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C12 H7 N3 O2 S - | - C12 H7 N3 O2 S - | - C48 H28 N12 O8 S4 - | 4 | 2 | KA1205 | Özbey, S.; Temel, A.; Özgün, B. H.; Ertan, N. | 2-(2-Thiazolylhydrazono)indan-1,3-dione | Acta Crystallographica Section C | 1,997 | 53 | 1 | 113 | 116 | 10.1107/S0108270196011742 | 0.71073 | MoKα | null | 0.038 | null | null | 0.041 | null | null | null | null | 0.93 | 0.93 | null | null | null | has coordinates | Özbey, S.; Temel, A.; Özgün, B. H.; Ertan, N.
2-(2-Thiazolylhydrazono)indan-1,3-dione
Acta Crystallographica Section C
53(1)
(1997)
113-116 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,875 | 30.136 | 0.009 | 6.902 | 0.002 | 16.92 | 0.006 | 90 | null | 120.23 | 0.02 | 90 | null | 3,040.7 | 1.8 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | Aquabis(salicyaldoximato)zinc | - C14 H14 N2 O5 Zn - | - C14 H14 N2 O5 Zn - | - C112 H112 N16 O40 Zn8 - | 8 | 1 | KA1207 | Potočňák, I.; Heinemann, F. W.; Rausch, M.; Steinborn, D. | Aquabis(salicylaldoximato)zinc | Acta Crystallographica Section C | 1,997 | 53 | 1 | 54 | 56 | 10.1107/S0108270196011353 | 0.71073 | MoKα | 0.072 | 0.0526 | null | 0.1746 | 0.1342 | null | null | null | 1.171 | 1.204 | 1.204 | null | null | null | has coordinates,has Fobs | Potočňák, I.; Heinemann, F. W.; Rausch, M.; Steinborn, D.
Aquabis(salicylaldoximato)zinc
Acta Crystallographica Section C
53(1)
(1997)
54-56 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,876 | 14.978 | 0.003 | 16.703 | 0.003 | 18.847 | 0.003 | 90 | null | 90 | null | 90 | null | 4,715.1 | 1.5 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | A b a 2 | A 2 -2ab | 41 | 1,2-bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine | - C25 H35 N3 O - | - C25 H35 N3 O - | - C200 H280 N24 O8 - | 8 | null | KA1214 | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N. | 1,2-Bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine | Acta Crystallographica Section C | 1,997 | 53 | 1 | 88 | 90 | 10.1107/S0108270196011080 | 1.54176 | CuKα | 0.0573 | 0.045 | null | 0.1331 | 0.1268 | null | null | null | 1.056 | 1.123 | 1.123 | null | null | null | has coordinates | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.
1,2-Bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine
Acta Crystallographica Section C
53(1)
(1997)
88-90 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,877 | 14.996 | 0.002 | 9.8324 | 0.0012 | 13.461 | 0.002 | 90 | null | 116.609 | 0.006 | 90 | null | 1,774.6 | 0.4 | 200 | 2 | 200 | 2 | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 4,6,8-Trimethylazulene-Picric Acid | - C19 H17 N3 O7 - | - C19 H17 N3 O7 - | - C76 H68 N12 O28 - | 4 | 1 | KA1217 | Näther, C.; Arad, C.; Bock, H. | The Donor–Acceptor Complex between 4,6,8-Trimethylazulene and Picric Acid | Acta Crystallographica Section C | 1,997 | 53 | 1 | 76 | 79 | 10.1107/S0108270196011766 | 0.71073 | MoKα | 0.0627 | 0.0459 | null | 0.1334 | 0.1203 | null | null | null | 1.025 | 1.053 | 1.053 | null | null | null | has coordinates | Näther, C.; Arad, C.; Bock, H.
The Donor–Acceptor Complex between 4,6,8-Trimethylazulene and Picric Acid
Acta Crystallographica Section C
53(1)
(1997)
76-79 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,878 | 5.3243 | 0.0007 | 6.9487 | 0.0011 | 12.1489 | 0.0014 | 83.429 | 0.011 | 87.055 | 0.009 | 71.914 | 0.009 | 424.4 | 0.1 | 200 | 2 | 200 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | N,N'-bis(4-metylbenzoyl)-p-phenylenediamine | N,N'-bis(4-methylbenzoyl)-1,4-benzenediamine | - C22 H20 N2 O2 - | - C22 H20 N2 O2 - | - C22 H20 N2 O2 - | 1 | 0.5 | KA1219 | Nagel, N.; Näther, C.; Bock, H. | <i>N</i>,<i>N</i>'-Bis(4-methylbenzoyl)-<i>p</i>-phenylenediamine at 200K | Acta Crystallographica Section C | 1,997 | 53 | 1 | 79 | 81 | 10.1107/S0108270196011778 | 0.71073 | MoKα | 0.0511 | 0.0399 | null | 0.1094 | 0.1011 | null | null | null | 1.061 | 1.083 | 1.083 | null | null | null | has coordinates | Nagel, N.; Näther, C.; Bock, H.
<i>N</i>,<i>N</i>'-Bis(4-methylbenzoyl)-<i>p</i>-phenylenediamine at 200K
Acta Crystallographica Section C
53(1)
(1997)
79-81 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,122 | 11.705 | 0.008 | 19.527 | 0.008 | 20.67 | 0.009 | 90 | null | 98.14 | 0.04 | 90 | null | 4,677 | 4 | 293 | null | null | null | null | null | null | null | 8 | P 1 21/n 1 | -P 2yn | 14 | - C54 H82 Mo6 N6 O20 P4 Pb2 S14 - | - C54 H82 Mo6 N6 O20 P4 Pb2 S14 - | - C108 H164 Mo12 N12 O40 P8 Pb4 S28 - | 2 | 0.5 | Rong-Min Yu; Shao-Fang Lu; Xiao-Ying Huang; Qiang-Jin Wu; Jian-Quan Huang | Synthesis and Structural Characterization of an Unusual Oxygen-Linked Double Cubane-Like Cluster {[Mo3PbOS3](OAc)2(py)3(dtp)2O}2 | Inorganic Chemistry | 1,999 | 38 | 3313 | 3315 | 10.1021/ic9703890 | 0.71073 | MoKα | null | 0.0564 | null | null | 0.0682 | null | null | null | null | 0.86 | 0.86 | null | null | null | has coordinates | Rong-Min Yu; Shao-Fang Lu; Xiao-Ying Huang; Qiang-Jin Wu; Jian-Quan Huang
Synthesis and Structural Characterization of an Unusual Oxygen-Linked Double Cubane-Like Cluster {[Mo3PbOS3](OAc)2(py)3(dtp)2O}2
Inorganic Chemistry
38
(1999)
3313-3315 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,879 | 18.07 | 0.003 | 21.23 | 0.004 | 9.021 | 0.002 | 90 | null | 90 | null | 90 | null | 3,460.7 | 1.2 | 296 | 1 | null | null | null | null | null | null | 5 | A b a 2 | A 2 -2ab | 41 | 1,2-Bis(diphenylphosphino)ethanebis(toluenethiol)palladium(II), Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~ | - C40 H38 P2 Pd S2 - | - C40 H38 P2 Pd S2 - | - C160 H152 P8 Pd4 S8 - | 4 | null | KH1116 | Su, W.; Hong, M.; Cao, R.; Liu, H. | [1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']bis(α-toluenethiolato-<i>S</i>)palladium(II), [Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~] | Acta Crystallographica Section C | 1,997 | 53 | 1 | 66 | 67 | 10.1107/S0108270196012036 | 0.71073 | MoKα | null | 0.039 | null | null | 0.054 | null | null | null | null | 1.23 | 1.23 | null | null | null | has coordinates | Su, W.; Hong, M.; Cao, R.; Liu, H.
[1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']bis(α-toluenethiolato-<i>S</i>)palladium(II), [Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~]
Acta Crystallographica Section C
53(1)
(1997)
66-67 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,880 | 6.09 | 0.004 | 7.66 | 0.004 | 10.356 | 0.007 | 90 | null | 90 | null | 90 | null | 483.1 | 0.5 | 298 | 1 | 298 | 1 | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | Phosphonoacetic acid | - C2 H5 O5 P - | - C2 H5 O5 P - | - C8 H20 O20 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0318 | 0.0252 | null | 0.0712 | 0.068 | null | null | null | 1.127 | 1.135 | 1.135 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,881 | 6.99 | 0.004 | 6.266 | 0.003 | 15.932 | 0.008 | 90 | null | 98.41 | 0.04 | 90 | null | 690.3 | 0.6 | 297 | 1 | 297 | 1 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Potassium phosphonoacetate hydrate | - C2 H6 K O6 P - | - C2 H6 K O6 P - | - C8 H24 K4 O24 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0555 | 0.0353 | null | 0.0995 | 0.0923 | null | null | null | 1.075 | 1.124 | 1.124 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,882 | 7.949 | 0.004 | 9.931 | 0.005 | 8.407 | 0.004 | 90 | null | 99.73 | 0.04 | 90 | null | 654.1 | 0.6 | 297 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Potassium phosphonoacetate hydrate | - C2 H6 K O6 P - | - C2 H6 K O6 P - | - C8 H24 K4 O24 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0822 | 0.0375 | null | 0.105 | 0.0934 | null | null | null | 1.041 | 1.084 | 1.084 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,121 | 7.045 | 0.001 | 7.421 | 0.001 | 9.966 | 0.002 | 109.25 | 0.03 | 99.22 | 0.03 | 95.02 | 0.03 | 480.01 | 0.18 | 153 | 2 | 153 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C7 H15 N4 O2 Pt0.5 - | - C7 H15 N4 O2 Pt0.5 - | - C14 H30 N8 O4 Pt - | 2 | 1 | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert | A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2) | Inorganic Chemistry | 1,999 | 38 | 3160 | 3166 | 10.1021/ic990044c | 0.71069 | MoKα | 0.0256 | 0.0254 | null | null | 0.0499 | 0.0499 | null | null | null | null | null | 1.038 | null | null | has coordinates | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert
A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)
Inorganic Chemistry
38
(1999)
3160-3166 | 301,838 | 2025-08-20 | 22:17:36 | #------------------------------------------------------------------------------
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2,005,883 | 6.812 | 0.004 | 10.258 | 0.004 | 9.285 | 0.004 | 90 | null | 100.84 | 0.04 | 90 | null | 637.2 | 0.5 | 303 | 1 | 303 | 1 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Ammonium phosphonoacetate | - C2 H8 N O5 P - | - C2 H8 N O5 P - | - C8 H32 N4 O20 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0665 | 0.0293 | null | 0.0879 | 0.0768 | null | null | null | 1.042 | 1.104 | 1.104 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,884 | 6.516 | 0.003 | 10.596 | 0.004 | 7.348 | 0.003 | 90 | null | 95.82 | 0.04 | 90 | null | 504.7 | 0.4 | 297 | 2 | 293 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Lithium phosphonoacetate | - C2 H4 Li O5 P - | - C2 H4 Li O5 P - | - C8 H16 Li4 O20 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.033 | 0.024 | null | 0.074 | 0.0702 | null | null | null | 1.076 | 1.101 | 1.101 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,885 | 5.806 | 0.002 | 17.43 | 0.006 | 14.607 | 0.005 | 90 | null | 90 | null | 90 | null | 1,478.2 | 0.9 | 295 | 1 | 295 | 2 | null | null | null | null | 5 | P c a 21 | P 2c -2ac | 29 | sodium phosphonoacetate dihydrate | - C2 H8 Na O7 P - | - C2 H8 Na O7 P - | - C16 H64 Na8 O56 P8 - | 8 | 2 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 1.5418 | CuKα | 0.0408 | 0.0378 | null | 0.1048 | 0.1026 | null | null | null | 1.082 | 1.107 | 1.107 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,886 | 9.26 | 0.004 | 10.163 | 0.004 | 6.885 | 0.004 | 90 | null | 95.95 | 0.04 | 90 | null | 644.5 | 0.5 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | dipotassium phosphonoacetate | - C2 H3 K2 O5 P - | - C2 H3 K2 O5 P - | - C8 H12 K8 O20 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0545 | 0.0272 | null | 0.0806 | 0.0731 | null | null | null | 1.013 | 1.085 | 1.085 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,322,120 | 7.104 | 0.001 | 7.549 | 0.002 | 9.209 | 0.002 | 87.74 | 0.03 | 88.04 | 0.03 | 85.92 | 0.03 | 491.98 | 0.18 | 136 | 2 | 136 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | trans-[Pt(NH2CH3)2(1-MeC-N4)2] * 4 H2O | - C6 H15 N4 O3 Pt0.5 - | - C6 H15 N4 O3 Pt0.5 - | - C12 H30 N8 O6 Pt - | 2 | 1 | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert | A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2) | Inorganic Chemistry | 1,999 | 38 | 3160 | 3166 | 10.1021/ic990044c | 0.71069 | MoKα | 0.0199 | 0.0199 | null | null | 0.0465 | 0.0465 | null | null | null | null | null | 1.031 | null | null | has coordinates | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert
A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)
Inorganic Chemistry
38
(1999)
3160-3166 | 301,838 | 2025-08-20 | 22:17:36 | #------------------------------------------------------------------------------
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2,005,887 | 9.568 | 0.007 | 10.407 | 0.009 | 7.087 | 0.006 | 90 | null | 93.89 | 0.07 | 90 | null | 704.1 | 1 | 150 | 2 | 150 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | diammonium phosphonoacetate | - C2 H11 N2 O5 P - | - C2 H11 N2 O5 P - | - C8 H44 N8 O20 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.039 | 0.0352 | null | 0.0955 | 0.0928 | null | null | null | 1.1 | 1.123 | 1.123 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,888 | 11.76 | 0.02 | 6.78 | 0.004 | 19.64 | 0.02 | 90 | null | 101.42 | 0.09 | 90 | null | 1,535 | 3 | 297 | 1 | 297 | 1 | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | disodium phosphonoacetate dihydrate | - C2 H7 Na2 O7 P - | - C2 H7 Na2 O7 P - | - C16 H56 Na16 O56 P8 - | 8 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0801 | 0.0513 | null | 0.1532 | 0.1371 | null | null | null | 1.034 | 1.104 | 1.104 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,889 | 6.883 | 0.006 | 10.982 | 0.009 | 14.148 | 0.009 | 90 | null | 90.19 | 0.06 | 90 | null | 1,069.4 | 1.4 | 150 | 1 | 150 | 1 | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | triammonium phosphonoacetate dihydrate | - C2 H18 N3 O7 P - | - C2 H18 N3 O7 P - | - C8 H72 N12 O28 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0592 | 0.0284 | null | 0.0863 | 0.0771 | null | null | null | 1.063 | 1.14 | 1.14 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,890 | 7.891 | 0.006 | 24.846 | 0.017 | 8.324 | 0.006 | 90 | null | 101.46 | 0.06 | 90 | null | 1,599 | 2 | 297 | 1 | 297 | 1 | null | null | null | null | 5 | P 1 21/m 1 | -P 2yb | 11 | trisodium phosphonoacetate decahydrate | - C2 H22 Na3 O15 P - | - C2 H22 Na3 O15 P - | - C8 H88 Na12 O60 P4 - | 4 | 1 | MU1260 | Lis, T. | Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O | Acta Crystallographica Section C | 1,997 | 53 | 1 | 28 | 42 | 10.1107/S0108270196009390 | 0.71073 | MoKα | 0.0719 | 0.0372 | null | 0.1027 | 0.0922 | null | null | null | 1.019 | 1.08 | 1.08 | null | null | null | has coordinates | Lis, T.
Phosphonoacetic Acid (H~3~AP) and its Salts KH~2~AP.H~2~ O, (NH~4~)H~2~AP, LiH~2~AP, NaH~2~AP.2H~2~ O, K~2~HAP, (NH~4~)~2~HAP, Na~2~HAP.2H~2~ O, (NH~4~)~3~AP.2H~2~ O and Na~3~AP.10H~2~O
Acta Crystallographica Section C
53(1)
(1997)
28-42 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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4,322,119 | 7.392 | 0.001 | 9.072 | 0.002 | 10.047 | 0.002 | 112.4 | 0.03 | 106.07 | 0.03 | 94.66 | 0.03 | 585.2 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C6 H12 Cl N4 O5 Pt0.5 - | - C6 H12 Cl N4 O5 Pt0.5 - | - C12 H24 Cl2 N8 O10 Pt - | 2 | 1 | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert | A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2) | Inorganic Chemistry | 1,999 | 38 | 3160 | 3166 | 10.1021/ic990044c | 0.71069 | MoKα | 0.0371 | 0.0297 | null | 0.0871 | 0.06 | null | null | null | 1.022 | 1.067 | 1.067 | null | null | null | has coordinates | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert
A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)
Inorganic Chemistry
38
(1999)
3160-3166 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,891 | 12.688 | 0.002 | 11.894 | 0.004 | 16.876 | 0.002 | 90 | null | 101.78 | 0.01 | 90 | null | 2,493.1 | 1 | 295 | null | 298 | null | null | null | null | null | 4 | P 1 21 1 | null | (+)-1-allyl-N'-(5R,8S)[9,10-didehydro-6-methylergolin-8-yl]-N,N-diethylurea (+)(S)-2-(6-methoxy-2-naphthyl)propionic acid | - C54 H68 N4 O9 - | - C54 H68 N4 O9 - | - C108 H136 N8 O18 - | 2 | 1 | NA1243 | Bachechi, F.; Flieger, M.; Sinibaldi, M. | Complex of a Lisuride Derivative and (<i>S</i>)-Naproxen | Acta Crystallographica Section C | 1,997 | 53 | 1 | 136 | 140 | 10.1107/S0108270196009870 | 1.54178 | CuKα | null | 0.049 | null | null | 0.0566 | null | null | null | null | 2.03 | 2.03 | null | null | null | has coordinates | Bachechi, F.; Flieger, M.; Sinibaldi, M.
Complex of a Lisuride Derivative and (<i>S</i>)-Naproxen
Acta Crystallographica Section C
53(1)
(1997)
136-140 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,892 | 12.6 | 0.003 | 7.258 | 0.001 | 6.162 | 0.001 | 90 | null | 114.49 | 0.03 | 90 | null | 512.8 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | C 1 2/m 1 | -C 2y | 12 | Diguanidinium hexafluorate silicate | - C2 H12 F6 N6 Si - | - C2 H12 F6 N6 Si - | - C4 H24 F12 N12 Si2 - | 2 | 0.25 | NA1247 | Waskowska, A. | Diguanidinium Hexafluorosilicate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 128 | 130 | 10.1107/S0108270196011717 | 0.71073 | MoKα | 0.0389 | 0.0304 | null | 0.062 | 0.059 | null | null | null | 1.04 | 1.052 | 1.052 | null | null | null | has coordinates | Waskowska, A.
Diguanidinium Hexafluorosilicate
Acta Crystallographica Section C
53(1)
(1997)
128-130 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,005,893 | 13.6293 | 0.0006 | 10.364 | 0.001 | 33.859 | 0.002 | 90 | null | 100.236 | 0.003 | 90 | null | 4,706.6 | 0.6 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 1,8-Dimethyl-5-(4-fluorophenyl)-2-(p-toluolylaminomethyl)-2,3-dihydro- 1H-1,4-benzodiazepine Monohydrate. | - C26 H28 F N3 O2 - | - C26 H28 F N3 O2 - | - C208 H224 F8 N24 O16 - | 8 | 2 | NA1261 | Peeters, O. M.; Blaton, N. M.; de Ranter, C. J. | 5-(4-Fluorophenyl)-1,8-dimethyl-2-(<i>p</i>-toluoylaminomethyl)-2,3-dihydro-1<i>H</i>-1,4-benzodiazepine Monohydrate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 95 | 97 | 10.1107/S0108270196011729 | 1.54184 | CuKα | 0.1319 | 0.0532 | null | 0.1799 | 0.1418 | null | null | null | 0.853 | 1.255 | 1.255 | null | null | null | has coordinates | Peeters, O. M.; Blaton, N. M.; de Ranter, C. J.
5-(4-Fluorophenyl)-1,8-dimethyl-2-(<i>p</i>-toluoylaminomethyl)-2,3-dihydro-1<i>H</i>-1,4-benzodiazepine Monohydrate
Acta Crystallographica Section C
53(1)
(1997)
95-97 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/58/2005893.cif $
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2,005,894 | 8.813 | 0.001 | 9.597 | 0.001 | 12.805 | 0.002 | 70.12 | 0.01 | 84.45 | 0.01 | 67.87 | 0.01 | 942.8 | 0.2 | 298 | null | 298 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | 2,6-dimethyl-4-(3-nitrophenyl)pyridinium-3,5-dicarboxylate nitrate monohydrate | - C15 H15 N3 O10 - | - C15 H21 N3 O13 - | - C30 H42 N6 O26 - | 2 | 1 | PA1241 | Rowan, K. R.; Holt, E. M. | 3,5-Dicarboxy-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate Monohydrate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 106 | 108 | 10.1107/S0108270196011821 | 0.71073 | MoKα | null | 0.046 | null | null | 0.0561 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Rowan, K. R.; Holt, E. M.
3,5-Dicarboxy-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate Monohydrate
Acta Crystallographica Section C
53(1)
(1997)
106-108 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,005,895 | 12.399 | 0.001 | 7.09 | 0.001 | 12.939 | 0.002 | 90 | null | 108.49 | 0.01 | 90 | null | 1,078.7 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | C 1 m 1 | C -2y | 8 | Osmiumstannat | - O14 Os3 Sn15 - | - O14 Os3 Sn15 - | - O28 Os6 Sn30 - | 2 | 0.5 | SK1025 | Söhnel, T.; Reichelt, W. | Os~3~Sn~15~O~14~, ein ternäres Oxid mit osmiumgefüllten Sn~6~-Oktaedern | Acta Crystallographica Section C | 1,997 | 53 | 1 | 9 | 11 | 10.1107/S0108270196009560 | 0.71073 | MoKα | 0.041 | 0.0344 | null | 0.0893 | 0.0871 | null | null | null | 1.049 | 1.074 | 1.074 | null | null | null | has coordinates | Söhnel, T.; Reichelt, W.
Os~3~Sn~15~O~14~, ein ternäres Oxid mit osmiumgefüllten Sn~6~-Oktaedern
Acta Crystallographica Section C
53(1)
(1997)
9-11 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,005,896 | 14.6057 | 0.0002 | 9.237 | 0.0001 | 18.6333 | 0.0003 | 90 | null | 91.79 | 0.001 | 90 | null | 2,512.64 | 0.06 | 298 | 2 | 298 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | - C25 H28 O11 - | - C25 H28 O11 - | - C100 H112 O44 - | 4 | 1 | SK1033 | Boehlow, T. R.; Rath, N. P.; Spilling, C. D. | Methyl 4-Hydroxy-3-[4-methoxy-2-(methoxymethyleneoxy)phenyl]-2-{[4-methoxy-2-(methoxymethyleneoxy)phenyl]methyl}-5-oxo-2,5-dihydrofuran-2-carboxylate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 92 | 95 | 10.1107/S0108270196011602 | 0.71073 | MoKα | 0.0913 | 0.0753 | null | 0.25 | 0.2142 | null | null | null | 1.095 | 1.085 | 1.085 | null | null | null | has coordinates | Boehlow, T. R.; Rath, N. P.; Spilling, C. D.
Methyl 4-Hydroxy-3-[4-methoxy-2-(methoxymethyleneoxy)phenyl]-2-{[4-methoxy-2-(methoxymethyleneoxy)phenyl]methyl}-5-oxo-2,5-dihydrofuran-2-carboxylate
Acta Crystallographica Section C
53(1)
(1997)
92-95 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/58/2005896.cif $
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2,005,897 | 16.942 | 0.001 | 16.942 | 0.001 | 5.9187 | 0.0004 | 90 | null | 90 | null | 120 | null | 1,471.25 | 0.16 | 298 | 2 | 298 | 2 | null | null | null | null | 4 | R 3 :H | R 3 | 146 | tribenzyltin chloride | chlorotris(phenylmethyl)stannane | - C21 H21 Cl Sn - | - C21 H21 Cl Sn - | - C63 H63 Cl3 Sn3 - | 3 | 0.333333 | SK1046 | Ng, S. W. | Tribenzyltin Chloride | Acta Crystallographica Section C | 1,997 | 53 | 1 | 56 | 58 | 10.1107/S0108270196011614 | 0.71073 | MoKα | 0.0229 | 0.0229 | null | 0.0563 | 0.0563 | null | null | null | 1.065 | 1.065 | 1.065 | null | null | null | has coordinates | Ng, S. W.
Tribenzyltin Chloride
Acta Crystallographica Section C
53(1)
(1997)
56-58 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,005,898 | 9.4512 | 0.0007 | 9.8717 | 0.0006 | 21.145 | 0.002 | 90 | null | 90.693 | 0.009 | 90 | null | 1,972.7 | 0.3 | 291 | null | 291 | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C10 H7 F3 O2 - | - C10 H7 F3 O2 - | - C80 H56 F24 O16 - | 8 | 2 | SX1008 | Swenson, D. C.; Lu, H.; Burton, D. J. | (<i>Z</i>)-3-Phenyl-2-(trifluoromethyl)prop-2-enoic Acid: a Hydrogen-Bonded Dimer | Acta Crystallographica Section C | 1,997 | 53 | 1 | 111 | 113 | 10.1107/S0108270196010803 | 1.54184 | CuKα | 0 | 0.056 | null | null | 0.082 | null | null | null | null | 1.175 | 1.175 | null | null | null | has coordinates | Swenson, D. C.; Lu, H.; Burton, D. J.
(<i>Z</i>)-3-Phenyl-2-(trifluoromethyl)prop-2-enoic Acid: a Hydrogen-Bonded Dimer
Acta Crystallographica Section C
53(1)
(1997)
111-113 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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4,322,118 | 5.937 | 0.001 | 8.228 | 0.002 | 12.47 | 0.002 | 80.36 | 0.03 | 80.8 | 0.03 | 80.54 | 0.03 | 586.9 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C6 H15 N5 O6 Pt0.5 - | - C6 H13 N5 O6 Pt0.5 - | - C12 H26 N10 O12 Pt - | 2 | 1 | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert | A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2) | Inorganic Chemistry | 1,999 | 38 | 3160 | 3166 | 10.1021/ic990044c | 0.71069 | MoKα | 0.0235 | 0.0232 | null | 0.0565 | 0.0546 | null | null | null | 1.055 | 1.055 | 1.055 | null | null | null | has coordinates | Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert
A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)
Inorganic Chemistry
38
(1999)
3160-3166 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,899 | 17.133 | 0.003 | 13.714 | 0.001 | 10.776 | 0.001 | 90 | null | 98.6 | 0.01 | 90 | null | 2,503.5 | 0.5 | 292.7 | null | 292.7 | null | null | null | null | null | 8 | P 1 21/n 1 | -P 2yn | 14 | - C50 H44 Cl2 Cu2 N2 O2 P2 S4 - | - C50 H44 Cl2 Cu2 N2 O2 P2 S4 - | - C100 H88 Cl4 Cu4 N4 O4 P4 S8 - | 2 | 0.5 | TA1094 | Shibahara, T.; Kobayashi, S.; Long, D.; Xin, X. | Bis{μ-chloro-[2(3<i>H</i>)-benzothiazolethione](triphenylphosphine)copper(I)} Dihydrate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 58 | 60 | 10.1107/S0108270196011961 | 1.5418 | CuKα | null | 0.065 | null | null | 0.0859 | null | null | null | null | 1.658 | 1.658 | null | null | null | has coordinates | Shibahara, T.; Kobayashi, S.; Long, D.; Xin, X.
Bis{μ-chloro-[2(3<i>H</i>)-benzothiazolethione](triphenylphosphine)copper(I)} Dihydrate
Acta Crystallographica Section C
53(1)
(1997)
58-60 | 199,607 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,900 | 14.453 | 0.002 | 10.149 | 0.003 | 17.136 | 0.001 | 90 | null | 91.315 | 0.007 | 90 | null | 2,512.9 | 0.8 | 213 | 1 | 213 | 1 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C22 H24 Cl3 N O8 - | - C22 H23 Cl3 N O8 - | - C88 H92 Cl12 N4 O32 - | 4 | 1 | TA1095 | Banwell, M. G.; Hockless, D. C. R.; Peters, S. C. | A Possible Synthetic Precursor to the Tropoloisoquinoline Alkaloid Pareirubrine A | Acta Crystallographica Section C | 1,997 | 53 | 1 | 109 | 111 | 10.1107/S0108270196009092 | 1.5418 | CuKα | null | 0.0615 | null | null | 0.0641 | null | null | null | null | 2.175 | 2.175 | null | null | null | has coordinates | Banwell, M. G.; Hockless, D. C. R.; Peters, S. C.
A Possible Synthetic Precursor to the Tropoloisoquinoline Alkaloid Pareirubrine A
Acta Crystallographica Section C
53(1)
(1997)
109-111 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,901 | 11.428 | 0.003 | 11.171 | 0.003 | 11.956 | 0.003 | 90 | null | 106.86 | 0.02 | 90 | null | 1,460.7 | 0.7 | 294 | 1 | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - H34 Mo6 N4 O30 Zn - | - H34 Mo6 N4 O30 Zn - | - H68 Mo12 N8 O60 Zn2 - | 2 | 0.5 | Allen, C. C.; Burns, R. C.; Lawrance, G. A.; Turner, P.; Hambley, T. W. | Tetraammonium Hexahydrogenhexamolybdozincate(II) Hexahydrate | Acta Crystallographica, Section C: Crystal Structure Communications | 1,997 | 53 | 1 | 7 | 9 | 10.1107/s0108270196011043 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Allen, C. C.; Burns, R. C.; Lawrance, G. A.; Turner, P.; Hambley, T. W.
Tetraammonium Hexahydrogenhexamolybdozincate(II) Hexahydrate
Acta Crystallographica, Section C: Crystal Structure Communications
53(1)
(1997)
7-9 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,902 | 9.405 | 0.001 | 7.669 | 0.002 | 9.436 | 0.001 | 90 | null | 104.177 | 0.009 | 90 | null | 659.9 | 0.2 | 296 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C6 H20 N3 O8 P - | - C6 H20 N3 O8 P - | - C12 H40 N6 O16 P2 - | 2 | 1 | TA1109 | Suga, T.; Okabe, N. | <small>L</small>-Histidinol Phosphate Tetrahydrate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 134 | 136 | 10.1107/S0108270196012516 | 0.71069 | MoKα | null | 0.036 | null | null | 0.049 | null | null | null | null | 1.87 | 1.87 | null | null | null | has coordinates | Suga, T.; Okabe, N.
<small>L</small>-Histidinol Phosphate Tetrahydrate
Acta Crystallographica Section C
53(1)
(1997)
134-136 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,903 | 15.804 | 0.002 | 15.112 | 0.002 | 12.684 | 0.002 | 90 | null | 104.89 | 0.01 | 90 | null | 2,927.6 | 0.7 | 296 | null | 23 | null | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | 14 | - C26 H28 Cl3 N6 O4 Sm - | - C26 Cl3 N6 O4 Sm - | - C104 Cl12 N24 O16 Sm4 - | 4 | 1 | TA1110 | Jin, H.-Y.; Akiba, M.; Umakoshi, K.; Sasaki, Y.; Kabuto, K. | Dichloro[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)ethylenediamine]samarium(III) Perchlorate | Acta Crystallographica Section C | 1,997 | 53 | 1 | 60 | 63 | 10.1107/S0108270196009924 | 0.71069 | MoKα | null | 0.049 | null | null | 0.043 | null | null | null | null | 2.248 | 2.248 | null | null | null | has coordinates | Jin, H.-Y.; Akiba, M.; Umakoshi, K.; Sasaki, Y.; Kabuto, K.
Dichloro[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)ethylenediamine]samarium(III) Perchlorate
Acta Crystallographica Section C
53(1)
(1997)
60-63 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,904 | 7.9656 | 0.0011 | 9.7996 | 0.001 | 12.036 | 0.002 | 86.45 | 0.02 | 80.28 | 0.02 | 77.45 | 0.02 | 903.6 | 0.2 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | 1,2-diphenyl-3-benzyl-guanidine hydrochloride | - C20 H20 Cl N3 - | - C20 H20 Cl N3 - | - C40 H40 Cl2 N6 - | 2 | 1 | TA1114 | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N. | 1,2-Diphenyl-3-benzylguanidine Hydrochloride | Acta Crystallographica Section C | 1,997 | 53 | 1 | 86 | 88 | 10.1107/S010827019601195X | 1.54176 | CuKα | 0.0366 | 0.0353 | null | 0.0929 | 0.0922 | null | null | null | 1.078 | 1.101 | 1.101 | null | null | null | has coordinates | Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N.
1,2-Diphenyl-3-benzylguanidine Hydrochloride
Acta Crystallographica Section C
53(1)
(1997)
86-88 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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2,005,905 | 16.331 | 0.006 | 29.61 | 0.01 | 10.854 | 0.005 | 90 | null | 90 | null | 90 | null | 5,249 | 4 | 296 | null | null | null | null | null | null | null | 7 | P n a 21 | P 2c -2n | 33 | - C50 H48 Cl4 N2 O7 P2 Re2 - | - C50 H44 Cl4 N2 O7 P2 Re2 - | - C200 H176 Cl16 N8 O28 P8 Re8 - | 4 | 1 | AB1373 | Gerber, T. I. A.; Perils, J.; Du Preez, J. G. H.; Bandoli, G. | Chelation of 2,6-Bis(hydroxymethyl)pyridine in <i>cis</i>-Dichloro(triphenylphosphine-<i>P</i>)[2-(oxymethylene-<i>O</i>)-6-(hydroxymethyl)pyridine-<i>N</i>]oxorhenium(V)‒Water (2/1) | Acta Crystallographica Section C | 1,997 | 53 | 2 | 217 | 219 | 10.1107/S0108270196013030 | 0.71073 | MoKα | null | 0.0443 | null | null | 0.0597 | null | null | null | null | 0.85 | 0.85 | null | null | null | has coordinates | Gerber, T. I. A.; Perils, J.; Du Preez, J. G. H.; Bandoli, G.
Chelation of 2,6-Bis(hydroxymethyl)pyridine in <i>cis</i>-Dichloro(triphenylphosphine-<i>P</i>)[2-(oxymethylene-<i>O</i>)-6-(hydroxymethyl)pyridine-<i>N</i>]oxorhenium(V)‒Water (2/1)
Acta Crystallographica Section C
53(2)
(1997)
217-219 | 191,095 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,906 | 12.356 | 0.0011 | 13.624 | 0.0012 | 14.705 | 0.0015 | 90 | null | 90 | null | 90 | null | 2,475.4 | 0.4 | 295 | null | null | null | null | null | null | null | 4 | P b c a | -P 2ac 2ab | 61 | - C12 H12 Mo O4 - | - C12 H14 Mo O4 - | - C96 H112 Mo8 O32 - | 8 | 1 | AB1394 | Ülkü, D.; Tahir, M. N.; Özkar, S. | Tetracarbonyl(η^2:2^-1,5-cyclooctadiene)molybdenum(0) | Acta Crystallographica Section C | 1,997 | 53 | 2 | 185 | 187 | 10.1107/S0108270196012723 | 0.71073 | MoKα | null | 0.029 | null | null | 0.034 | null | null | null | null | 0.74 | 0.74 | null | null | null | has coordinates | Ülkü, D.; Tahir, M. N.; Özkar, S.
Tetracarbonyl(η^2:2^-1,5-cyclooctadiene)molybdenum(0)
Acta Crystallographica Section C
53(2)
(1997)
185-187 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,005,907 | 7.627 | 0.001 | 9.054 | 0.001 | 14.6 | 0.001 | 78.64 | 0.01 | 84.91 | 0.01 | 63.67 | 0.01 | 885.9 | 0.18 | 298 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C34 H42 Co N4 O10 - | - C34 H42 Co N4 O10 - | - C34 H42 Co N4 O10 - | 1 | 0.5 | AB1409 | Hökelek, T.; Necefouglu, H. | Diaquabis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)bis(2-hydroxybenzoato-<i>O</i>)cobalt(II) | Acta Crystallographica Section C | 1,997 | 53 | 2 | 187 | 189 | 10.1107/S0108270196013170 | 0.71073 | MoKα | null | 0.05 | null | null | 0.056 | null | null | null | null | 1.56 | 1.56 | null | null | null | has coordinates | Hökelek, T.; Necefouglu, H.
Diaquabis(<i>N</i>,<i>N</i>-diethylnicotinamide-<i>N</i>^1^)bis(2-hydroxybenzoato-<i>O</i>)cobalt(II)
Acta Crystallographica Section C
53(2)
(1997)
187-189 | 301,791 | 2025-08-18 | 23:15:28 | #------------------------------------------------------------------------------
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