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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,009,556 | 3.6974 | 0.0009 | 3.6974 | 0.0009 | 9.508 | 0.002 | 90 | null | 90 | null | 90 | null | 129.98 | 0.05 | 295 | null | null | null | null | null | null | null | 3 | P 4/n m m :2 | -P 4a 2a | 129 | - Si Te Zr - | - Si Te Zr - | - Si2 Te2 Zr2 - | 2 | 0.125 | SE1027 | Bensch, W.; Dürichen, P. | Structure of the layer compound ZrSiTe | Acta Crystallographica Section C | 1,994 | 50 | 3 | 346 | 348 | 10.1107/S0108270193008303 | 0.7107 | MoKα | null | null | null | null | null | null | null | null | null | 1.3 | 1.3 | null | null | null | has coordinates | Bensch, W.; Dürichen, P.
Structure of the layer compound ZrSiTe
Acta Crystallographica Section C
50(3)
(1994)
346-348 | 302,837 | 2025-10-08 | 10:28:19 | #------------------------------------------------------------------------------
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2,009,557 | 25.365 | 0.003 | 14.985 | 0.002 | 12.315 | 0.002 | 90 | null | 90 | null | 90 | null | 4,680.9 | 1.1 | 292 | null | null | null | null | null | null | null | 5 | P n m a | -P 2ac 2n | 62 | - Cr3 H32 K3 O51 Si - | - Cr3 K3 O51 Si W9 - | - Cr12 K12 O204 Si4 W36 - | 4 | 0.5 | SE1029 | Wassermann, K.; Lunk, H.-J.; Palm, R.; Fuchs, J. | A novel triply chromium(III)-substituted keggin anion, [<i>A</i>-α-SiO~4~W~9~Cr~3~(OH~2~)~3~O~33~]^7{‒^} | Acta Crystallographica Section C | 1,994 | 50 | 3 | 348 | 350 | 10.1107/S0108270193008601 | 0.71069 | MoKα | null | 0.063 | null | null | 0.063 | null | null | null | null | 1.019 | 1.019 | null | null | null | has coordinates | Wassermann, K.; Lunk, H.-J.; Palm, R.; Fuchs, J.
A novel triply chromium(III)-substituted keggin anion, [<i>A</i>-α-SiO~4~W~9~Cr~3~(OH~2~)~3~O~33~]^7{‒^}
Acta Crystallographica Section C
50(3)
(1994)
348-350 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,558 | 9.523 | 0.002 | 12.849 | 0.003 | 17.079 | 0.003 | 90 | null | 92.67 | 0.03 | 90 | null | 2,087.5 | 0.8 | 291 | 1 | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C16 H18 N6 S3 Sn - | - C16 H18 N6 S3 Sn - | - C64 H72 N24 S12 Sn4 - | 4 | 2 | SE1034 | Schmiedgen, R.; Huber, F.; Schürmann, M. | <i>n</i>-Butyltris(2-pyrimidinethiolato-<i>N</i>,<i>S</i>)tin(IV) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 391 | 394 | 10.1107/S0108270193008315 | 0.71073 | MoKα | null | 0.0293 | null | null | 0.0231 | null | null | null | null | 0.75 | 0.75 | null | null | null | has coordinates | Schmiedgen, R.; Huber, F.; Schürmann, M.
<i>n</i>-Butyltris(2-pyrimidinethiolato-<i>N</i>,<i>S</i>)tin(IV)
Acta Crystallographica Section C
50(3)
(1994)
391-394 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,820 | 13.0052 | 0.0002 | 11.224 | 0.0002 | 14.307 | 0.0003 | 90 | null | 93.19 | 0.001 | 90 | null | 2,085.16 | 0.07 | 298 | 2 | 298 | 2 | null | null | null | null | 6 | P 1 21 1 | P 2yb | 4 | - C42 H41 In N2 P2 S4 - | - C42 H41 In N2 P2 S4 - | - C84 H82 In2 N4 P4 S8 - | 2 | 1 | Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta | Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{PhP(C6H4S-2)2}2].CH3CN | Inorganic Chemistry | 1,999 | 38 | 1293 | 1298 | 10.1021/ic980282s | 0.71073 | MoKα | 0.0381 | 0.0352 | null | 0.0929 | 0.0869 | null | null | null | 1.122 | 1.1 | 1.1 | null | null | null | has coordinates | Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta
Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{P... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:18:08 +0200 (Wed, 23 Mar 2016) $
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2,009,559 | 7.52 | 0.002 | 11.857 | 0.004 | 10.925 | 0.002 | 90 | null | 108.83 | 0.02 | 90 | null | 922 | 0.4 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 2,6-Difluorophenylxenon(II)-tetrafluoroborate | - C6 H3 B F6 Xe - | - C6 H3 B F6 Xe - | - C24 H12 B4 F24 Xe4 - | 4 | 1 | SE1035 | Gilles, Theo; Gnann, Robert; Naumann, Dieter; Tebbe, Karl-Friedrich | 2,6-Difluorphenylxenon(II)-tetrafluoroborat | Acta Crystallographica Section C | 1,994 | 50 | 3 | 411 | 413 | 10.1107/S0108270193009898 | 0.71069 | MoKα | 0.0436 | 0.0369 | null | 0.0355 | 0.0351 | null | null | null | 3.7047 | 3.9635 | 3.9635 | null | null | null | has coordinates | Gilles, Theo; Gnann, Robert; Naumann, Dieter; Tebbe, Karl-Friedrich
2,6-Difluorphenylxenon(II)-tetrafluoroborat
Acta Crystallographica Section C
50(3)
(1994)
411-413 | 255,773 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,560 | 22.156 | 0.006 | 8.979 | 0.002 | 15.897 | 0.003 | 90 | 0.01 | 112.52 | 0.02 | 90 | 0.01 | 2,921.4 | 1.2 | 293 | null | null | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | di-μ-iodocyclohexylphosphanido-bis-tetracarbonylrhenium | - C20 H22 I2 O8 P2 Re2 - | - C20 H22 I2 O8 P2 Re2 - | - C80 H88 I8 O32 P8 Re8 - | 4 | 0.5 | SE1036 | Flörke, Ulrich; Haupt, Hans-Jürgen | Unexpected Re~2~P~2~ ring deformation in bis[μ-cyclohexyl(iodo)phosphido-κ<i>P</i>]bis(tetracarbonylrhenium), [Re~2~(C~6~H~11~IP)~2~(CO)~8~] | Acta Crystallographica Section C | 1,994 | 50 | 3 | 378 | 380 | 10.1107/S0108270193009904 | 0.71073 | MolybdenumKα | null | 0.045 | null | null | 0.041 | null | null | null | null | 1.868 | 1.868 | null | null | null | has coordinates | Flörke, Ulrich; Haupt, Hans-Jürgen
Unexpected Re~2~P~2~ ring deformation in bis[μ-cyclohexyl(iodo)phosphido-κ<i>P</i>]bis(tetracarbonylrhenium), [Re~2~(C~6~H~11~IP)~2~(CO)~8~]
Acta Crystallographica Section C
50(3)
(1994)
378-380 | 208,362 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-06-14 06:45:12 +0300 (Thu, 14 Jun 2018) $
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2,009,561 | 7.2198 | 0.0007 | 7.2198 | 0.0007 | 4.2329 | 0.0007 | 90 | null | 90 | null | 120 | null | 191.08 | 0.04 | 295 | null | null | null | null | null | null | null | 3 | P -6 2 m | P -6 -2 | null | - Al Ce Pd - | - Al Ce Pd - | - Al3 Ce3 Pd3 - | 3 | 0.25 | SH1059 | Xue, B.; Schwer, H.; Hulliger, F. | Structure of CePdAl | Acta Crystallographica Section C | 1,994 | 50 | 3 | 338 | 340 | 10.1107/S0108270193007632 | 0.71073 | MoKα | null | 0.042 | null | null | 0.113 | null | null | null | null | 1.857 | 1.857 | null | null | null | has coordinates | Xue, B.; Schwer, H.; Hulliger, F.
Structure of CePdAl
Acta Crystallographica Section C
50(3)
(1994)
338-340 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,562 | 7.135 | 0.002 | 7.946 | 0.004 | 9.039 | 0.001 | 109.25 | 0.03 | 99.62 | 0.02 | 104.44 | 0.02 | 450.8 | 0.3 | 295 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C10 H12 Cd N10 O12 - | - C10 H12 Cd N10 O12 - | - C10 H12 Cd N10 O12 - | 1 | 0.5 | SH1062 | Hänggi, G.; Schmalle, H.; Dubler, E. | Cd(alloxanthine)~2~(NO~3~)~2~(H~2~O)~2~ | Acta Crystallographica Section C | 1,994 | 50 | 3 | 388 | 391 | 10.1107/S0108270193008832 | 0.71073 | MoKα | null | 0.033 | null | null | 0.039 | null | null | null | null | 0.535 | 0.535 | null | null | null | has coordinates | Hänggi, G.; Schmalle, H.; Dubler, E.
Cd(alloxanthine)~2~(NO~3~)~2~(H~2~O)~2~
Acta Crystallographica Section C
50(3)
(1994)
388-391 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,563 | 9.225 | 0.002 | 10.141 | 0.003 | 20.198 | 0.004 | 98.65 | 0.01 | 98.34 | 0.01 | 101.7 | 0.01 | 1,798.9 | 0.8 | 295 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C19 H22 O4 S - | - C19 H22 O4 S - | - C76 H88 O16 S4 - | 4 | 2 | SH1064 | Raabe, G.; Sawicki, M.; Frauenrath, H. | <i>trans</i>-2-Phenyltetrahydropyran-3-ylmethyl <i>p</i>-toluenesulfonate | Acta Crystallographica Section C | 1,994 | 50 | 3 | 462 | 466 | 10.1107/S0108270193008406 | 0.71069 | MoKα | null | 0.053 | null | null | 0.056 | null | null | null | null | 2.738 | 2.738 | null | null | null | has coordinates | Raabe, G.; Sawicki, M.; Frauenrath, H.
<i>trans</i>-2-Phenyltetrahydropyran-3-ylmethyl <i>p</i>-toluenesulfonate
Acta Crystallographica Section C
50(3)
(1994)
462-466 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,564 | 5.486 | 0.001 | 5.486 | 0.001 | 17.574 | 0.003 | 90 | null | 90 | null | 120 | null | 458.05 | 0.14 | 295 | null | null | null | null | null | null | null | 4 | P 63/m m c | -P 6c 2c | null | - Co2 K2 O9 Se3 - | - Co2 K2 O9 Se4 - | - Co4 K4 O18 Se8 - | 2 | 0.083333 | SH1067 | Wildner, M. | Structure of K~2~Co~2~(SeO~3~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 3 | 336 | 338 | 10.1107/S0108270193008479 | 0.71073 | MoKα | null | 0.038 | null | null | 0.034 | null | null | null | null | 4.12 | 4.12 | null | null | null | has coordinates | Wildner, M.
Structure of K~2~Co~2~(SeO~3~)~3~
Acta Crystallographica Section C
50(3)
(1994)
336-338 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,565 | 11.099 | 0.003 | 15.2 | 0.004 | 4.416 | 0.002 | 95.23 | 0.03 | 96.84 | 0.03 | 93.74 | 0.02 | 734.4 | 0.4 | 173 | null | 173 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | 6-(2-furfurylamino)-2-(2-furyl)-4-methylthio-5-nitropyrimidine | - C14 H12 N4 O4 S - | - C14 H12 N4 O4 S - | - C28 H24 N8 O8 S2 - | 2 | 1 | SH1074 | Linden, Anthony; Heimgartner, Heinz; García Trimiño, Maria Isabel; Macías Cabrera, Arturo | 5-Nitropyrimidines from 3,3-diamino(2-nitro)thioacrylamides. Structure of 6-(2-furfurylamino)-2-(2-furyl)-4-methylthio-5-nitropyrimidine | Acta Crystallographica Section C | 1,994 | 50 | 3 | 421 | 424 | 10.1107/S0108270193008558 | 0.71069 | MoKα | 0.1009 | 0.0456 | null | 0.0486 | 0.0427 | null | null | null | null | 1.64 | 1.64 | null | null | null | has coordinates | Linden, Anthony; Heimgartner, Heinz; García Trimiño, Maria Isabel; Macías Cabrera, Arturo
5-Nitropyrimidines from 3,3-diamino(2-nitro)thioacrylamides. Structure of 6-(2-furfurylamino)-2-(2-furyl)-4-methylthio-5-nitropyrimidine
Acta Crystallographica Section C
50(3)
(1994)
421-424 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,566 | 8.8281 | 0.0011 | 8.8281 | 0.0011 | 9.104 | 0.002 | 90 | null | 90 | null | 120 | null | 614.47 | 0.17 | 108 | null | null | null | null | null | null | null | 4 | R 3 | R 3 | null | - H13 Mg O9 P - | - H13 Mg O9 P - | - H39 Mg3 O27 P3 - | 3 | null | ST1056 | Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C. | Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^} | Acta Crystallographica Section C | 1,994 | 50 | 3 | 342 | 346 | 10.1107/S0108270193008169 | 1.54178 | CuKα | null | 0.0209 | null | null | 0.0255 | null | null | null | null | 1.23 | 1.23 | null | null | null | has coordinates | Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C.
Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^}
Acta Crystallographica Section C
50(3)
(1994)
342-346 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,819 | 16.6579 | 0.0001 | 12.6628 | 0.0002 | 22.552 | 0.0003 | 90 | null | 96.42 | 0.01 | 90 | null | 4,727.19 | 0.14 | 298 | 2 | 298 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C54 H42 In P3 S3 - | - C54 H42 In P3 S3 - | - C216 H168 In4 P12 S12 - | 4 | 1 | Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta | Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{PhP(C6H4S-2)2}2].CH3CN | Inorganic Chemistry | 1,999 | 38 | 1293 | 1298 | 10.1021/ic980282s | 0.71073 | MoKα | null | 0.0579 | null | 0.1522 | 0.1392 | null | null | null | 1.03 | 1.107 | 1.107 | null | null | null | has coordinates | Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta
Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{P... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,567 | 8.868 | 0.002 | 8.868 | 0.002 | 9.15 | 0.002 | 90 | null | 90 | null | 120 | null | 623.2 | 0.2 | 293 | null | null | null | null | null | null | null | 4 | R 3 | R 3 | null | - H13 Mg O9 P - | - H13 Mg O9 P - | - H39 Mg3 O27 P3 - | 3 | null | ST1056 | Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C. | Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^} | Acta Crystallographica Section C | 1,994 | 50 | 3 | 342 | 346 | 10.1107/S0108270193008169 | neutron | 1.063 | Neutron(Cu[220]) | null | 0.041 | null | null | 0.023 | null | null | null | null | 2.77 | 2.77 | null | null | null | has coordinates | Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C.
Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^}
Acta Crystallographica Section C
50(3)
(1994)
342-346 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,568 | 14.053 | 0.003 | 10.781 | 0.005 | 21.406 | 0.005 | 90 | null | 102.84 | 0.02 | 90 | null | 3,162 | 1.8 | 294 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C36 H44 Fe N3 O4 - | - C38 H39 Fe N3 O4 - | - C152 H156 Fe4 N12 O16 - | 4 | 1 | ST1080 | Vencato, Ivo; Neves, Ademir; Vincent, Beverly R.; Erasmus-Buhr, Claudia; Haase, Wolfgang | Synthesis and structure of the new complex Et~3~NH[Fe(tben)] | Acta Crystallographica Section C | 1,994 | 50 | 3 | 386 | 388 | 10.1107/S0108270193009758 | 0.71069 | MoKα | null | 0.047 | null | null | 0.058 | null | null | null | null | 1.31 | 1.31 | null | null | null | has coordinates | Vencato, Ivo; Neves, Ademir; Vincent, Beverly R.; Erasmus-Buhr, Claudia; Haase, Wolfgang
Synthesis and structure of the new complex Et~3~NH[Fe(tben)]
Acta Crystallographica Section C
50(3)
(1994)
386-388 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
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2,009,569 | 12.363 | 0.015 | 13.134 | 0.014 | 13.584 | 0.012 | 65.57 | 0.07 | 64.92 | 0.08 | 65.18 | 0.08 | 1,737 | 4 | 293 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C39 H28 Cu2 N9 O2 S - | - C39 H28 Cu2 N9 O2 S - | - C78 H56 Cu4 N18 O4 S2 - | 2 | 1 | VS1008 | Potočňák, I.; Dunaj-Jurčo, M.; Kabešová, M.; Mikloš, D.; Kettmann, V. | Bis(1,10-phenanthroline)copper(II)-μ-cyano-cyano(1,10-phenanthroline)copper(I) thiocyanate dihydrate | Acta Crystallographica Section C | 1,994 | 50 | 3 | 380 | 383 | 10.1107/S0108270193008327 | 0.71069 | MoKα | null | 0.046 | null | null | 0.052 | null | null | null | null | 0.46 | 0.46 | null | null | null | has coordinates | Potočňák, I.; Dunaj-Jurčo, M.; Kabešová, M.; Mikloš, D.; Kettmann, V.
Bis(1,10-phenanthroline)copper(II)-μ-cyano-cyano(1,10-phenanthroline)copper(I) thiocyanate dihydrate
Acta Crystallographica Section C
50(3)
(1994)
380-383 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,570 | 9.997 | 0.002 | 10.347 | 0.002 | 12.68 | 0.001 | 90 | null | 90 | null | 90 | null | 1,311.6 | 0.4 | 105 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C10 H22 N2 O5 - | - C10 H22 N2 O5 - | - C40 H88 N8 O20 - | 4 | 1 | AB0303 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. | Structures of the choline ion in different crystal surroundings | Acta Crystallographica Section C | 1,994 | 50 | 4 | 617 | 623 | 10.1107/S0108270193007589 | 0.71073 | MoKα | null | 0.041 | null | null | 0.043 | null | null | null | null | 0.696 | 0.696 | null | null | null | has coordinates | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M.
Structures of the choline ion in different crystal surroundings
Acta Crystallographica Section C
50(4)
(1994)
617-623 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,818 | 10.431 | 0.0002 | 11.4723 | 0.0002 | 11.7779 | 0.0002 | 112.263 | 0.001 | 99.093 | 0.001 | 102.318 | 0.001 | 1,229.06 | 0.04 | 296 | null | 296 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | [In4(4,4'-bipy)3(HPO4)4(H2PO4)4] | - C30 H36 In4 N6 O32 P8 - | - C30 In4 N6 O32 P8 - | - C30 In4 N6 O32 P8 - | 1 | 0.5 | Kwang-Hwa Lii; Yuh-Feng Huang | Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure | Inorganic Chemistry | 1,999 | 38 | 1348 | 1350 | 10.1021/ic9715106 | 0.71073 | MoKα | 0.1087 | 0.0702 | null | 0.1864 | 0.1661 | null | null | null | 1.007 | 1.119 | 1.119 | null | null | null | has coordinates | Kwang-Hwa Lii; Yuh-Feng Huang
Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure
Inorganic Chemistry
38
(1999)
1348-1350 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,571 | 6.228 | 0.001 | 6.819 | 0.001 | 7.494 | 0.001 | 95.42 | 0.02 | 99.48 | 0.01 | 108.99 | 0.01 | 293.07 | 0.08 | 122 | null | null | null | null | null | null | null | 4 | P 1 | P 1 | 1 | - C9 H19 N O7 - | - C9 H19 N O7 - | - C9 H19 N O7 - | 1 | 1 | AB0303 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. | Structures of the choline ion in different crystal surroundings | Acta Crystallographica Section C | 1,994 | 50 | 4 | 617 | 623 | 10.1107/S0108270193007589 | 0.71073 | MoKα | null | 0.053 | null | null | 0.074 | null | null | null | null | 1.797 | 1.797 | null | null | null | has coordinates | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M.
Structures of the choline ion in different crystal surroundings
Acta Crystallographica Section C
50(4)
(1994)
617-623 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,572 | 21.438 | 0.003 | 8.161 | 0.001 | 21.655 | 0.006 | 90 | null | 109.98 | 0.02 | 90 | null | 3,560.6 | 1.3 | 295 | null | null | null | null | null | null | null | 4 | I 1 2/a 1 | -I 2ya | 15 | - C16 H26 N2 O4 - | - C16 H26 N2 O4 - | - C128 H208 N16 O32 - | 8 | 1 | AB0303 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. | Structures of the choline ion in different crystal surroundings | Acta Crystallographica Section C | 1,994 | 50 | 4 | 617 | 623 | 10.1107/S0108270193007589 | 0.71073 | MoKα | null | 0.041 | null | null | 0.061 | null | null | null | null | 1.331 | 1.331 | null | null | null | has coordinates | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M.
Structures of the choline ion in different crystal surroundings
Acta Crystallographica Section C
50(4)
(1994)
617-623 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,573 | 7.951 | 0.002 | 10.6133 | 0.0009 | 23.421 | 0.004 | 90 | null | 90 | null | 90 | null | 1,976.4 | 0.6 | 105 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C18 H32 N2 O6 - | - C18 H32 N2 O6 - | - C72 H128 N8 O24 - | 4 | 1 | AB0303 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. | Structures of the choline ion in different crystal surroundings | Acta Crystallographica Section C | 1,994 | 50 | 4 | 617 | 623 | 10.1107/S0108270193007589 | 0.71073 | MoKα | null | 0.031 | null | null | 0.039 | null | null | null | null | 0.96 | 0.96 | null | null | null | has coordinates | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M.
Structures of the choline ion in different crystal surroundings
Acta Crystallographica Section C
50(4)
(1994)
617-623 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,574 | 20.182 | 0.006 | 9.062 | 0.003 | 24.028 | 0.006 | 90 | null | 90.79 | 0.02 | 90 | null | 4,394 | 2 | 294 | null | null | null | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | null | - C37 H26 Au Co3 O11 P2 Ru - | - C37 H26 Au Cl6 Co3 O11 P2 Ru - | - C148 H104 Au4 Cl24 Co12 O44 P8 Ru4 - | 4 | 1 | AB1078 | Kakkonen, H. J.; Ahlgrèn, M.; Pakkanen, T. A.; Pursiainen, J. | [AuCo~3~Ru(C~8~H~11~P)(C~18~H~15~P)(CO)~11~].1/2CH~2~Cl~2~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 528 | 530 | 10.1107/S0108270193009710 | 0.71073 | MoKα | null | 0.05 | null | null | 0.058 | null | null | null | null | 1.51 | 1.51 | null | null | null | has coordinates | Kakkonen, H. J.; Ahlgrèn, M.; Pakkanen, T. A.; Pursiainen, J.
[AuCo~3~Ru(C~8~H~11~P)(C~18~H~15~P)(CO)~11~].1/2CH~2~Cl~2~
Acta Crystallographica Section C
50(4)
(1994)
528-530 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,575 | 10.521 | 0.001 | 18.425 | 0.003 | 18.449 | 0.002 | 90 | null | 90 | null | 90 | null | 3,576.3 | 0.8 | 295 | null | null | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | null | - C14 H16 Cl2 N8 Zn - | - C14 H16 Cl2 N8 Zn - | - C112 H128 Cl16 N64 Zn8 - | 8 | 1 | AB1080 | Salas, J.M.; Romero, M.A.; Rahmani, A.; Faure, R. | Dichlorobis(5,7-dimethyl[1,2,4]triazolo[1,5-<i>a</i>]pyrimidine-<i>N</i>^3^)zinc(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 510 | 512 | 10.1107/S0108270193009448 | 0.7107 | MoKα | null | 0.026 | null | null | 0.027 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Salas, J.M.; Romero, M.A.; Rahmani, A.; Faure, R.
Dichlorobis(5,7-dimethyl[1,2,4]triazolo[1,5-<i>a</i>]pyrimidine-<i>N</i>^3^)zinc(II)
Acta Crystallographica Section C
50(4)
(1994)
510-512 | 191,053 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,817 | 10.5429 | 0.0004 | 11.6345 | 0.0005 | 11.7303 | 0.0005 | 110.116 | 0.001 | 100.445 | 0.001 | 104.339 | 0.001 | 1,251.58 | 0.09 | 296 | null | 296 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O | - C30 H44 In4 N6 O36 P8 - | - C30 In4 N6 O36 P8 - | - C30 In4 N6 O36 P8 - | 1 | 0.5 | Kwang-Hwa Lii; Yuh-Feng Huang | Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure | Inorganic Chemistry | 1,999 | 38 | 1348 | 1350 | 10.1021/ic9715106 | 0.71073 | MoKα | 0.0867 | 0.0517 | null | 0.1163 | 0.1034 | null | null | null | 1.048 | 1.119 | 1.119 | null | null | null | has coordinates | Kwang-Hwa Lii; Yuh-Feng Huang
Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure
Inorganic Chemistry
38
(1999)
1348-1350 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,576 | 8.526 | 0.003 | 10.856 | 0.004 | 14.448 | 0.004 | 90 | null | 106.48 | 0.05 | 90 | null | 1,282.3 | 0.8 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C14 H15 O P - | - C14 H15 O P - | - C56 H60 O4 P4 - | 4 | 1 | AB1090 | Orama, O.; Koskinen, J.T. | Ethyldiphenylphosphine oxide, (C~6~H~5~)~2~(C~2~H~5~)PO | Acta Crystallographica Section C | 1,994 | 50 | 4 | 608 | 609 | 10.1107/S0108270193009722 | 0.71069 | MoKα | null | 0.039 | null | null | 0.043 | null | null | null | null | 1.61 | 1.61 | null | null | null | has coordinates | Orama, O.; Koskinen, J.T.
Ethyldiphenylphosphine oxide, (C~6~H~5~)~2~(C~2~H~5~)PO
Acta Crystallographica Section C
50(4)
(1994)
608-609 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,577 | 9.794 | 0.002 | 9.614 | 0.002 | 13.105 | 0.002 | 90 | null | 107.74 | 0.02 | 90 | null | 1,175.3 | 0.4 | 295 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C8 H32 B20 Si2 - | - C8 H32 B20 Si2 - | - C16 H64 B40 Si4 - | 2 | 0.5 | AB1091 | Kivekäs, R.; Romerosa, A.; Viñas, C. | 1,1';2,2'-Bis-μ-dimethylsilyl-bis[1,2-dicarba-<i>closo</i>-dodecaborane(12)], C~8~H~32~B~20~Si~2~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 638 | 640 | 10.1107/S0108270193009734 | 0.71069 | MoKα | null | 0.062 | null | null | 0.053 | null | null | null | null | 2.64 | 2.64 | null | null | null | has coordinates | Kivekäs, R.; Romerosa, A.; Viñas, C.
1,1';2,2'-Bis-μ-dimethylsilyl-bis[1,2-dicarba-<i>closo</i>-dodecaborane(12)], C~8~H~32~B~20~Si~2~
Acta Crystallographica Section C
50(4)
(1994)
638-640 | 198,487 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,578 | 6.5051 | 0.0011 | 6.8828 | 0.0018 | 16.681 | 0.003 | 86.036 | 0.016 | 79.892 | 0.018 | 75.458 | 0.018 | 711.5 | 0.3 | 293 | null | 293 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | tricarbonyl(η^6^-phenyltrimethylsilane)molybdenum | tricarbonyl(η^6^-phenyltrimethylsilane)molybdenum | - C12 H14 Mo O3 Si - | - C12 H14 Mo O3 Si - | - C24 H28 Mo2 O6 Si2 - | 2 | 1 | AB1152 | Alyea, Elmer C.; Ferguson, George; Jain, Vimal K. | Tricarbonyl(η^6^-trimethylphenylsilane)molybdenum | Acta Crystallographica Section C | 1,994 | 50 | 4 | 491 | 493 | 10.1107/S0108270194000831 | 0.71067 | MoKα | 0.061 | 0.053 | null | 0.076 | 0.075 | null | null | null | null | 1.92 | 1.92 | null | null | null | has coordinates | Alyea, Elmer C.; Ferguson, George; Jain, Vimal K.
Tricarbonyl(η^6^-trimethylphenylsilane)molybdenum
Acta Crystallographica Section C
50(4)
(1994)
491-493 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,579 | 14.556 | 0.002 | 11.759 | 0.002 | 9.473 | 0.002 | 90 | null | 104.1 | 0.2 | 90 | null | 1,572.6 | 1.5 | 298 | null | 298 | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | (Z)-Aib-Gly-L-Ile-L-Leu-OMe_monohydrate | N^α^-benzyloxycarbonyl-α-aminoisobutyryl-glycyl-L-isoleucyl- L-leucine methyl ester monohydrate | - C27 H44 N4 O8 - | - C27 H44 N4 O8 - | - C54 H88 N8 O16 - | 2 | 1 | AD1000 | Crisma, Marco; Valle, Giovanni; Monaco, Vania; Formaggio, Fernando; Toniolo, Claudio | <i>N</i>^{α^}-Benzyloxycarbonyl-α-aminoisobutyrylglycyl-<small>L</small>-isoleucyl-<small>L</small>-leucine methyl ester monohydrate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 563 | 565 | 10.1107/S0108270193010595 | 0.7107 | MoKα | null | 0.045 | null | null | 0.049 | null | null | null | null | 0.892 | 0.892 | null | null | null | has coordinates | Crisma, Marco; Valle, Giovanni; Monaco, Vania; Formaggio, Fernando; Toniolo, Claudio
<i>N</i>^{α^}-Benzyloxycarbonyl-α-aminoisobutyrylglycyl-<small>L</small>-isoleucyl-<small>L</small>-leucine methyl ester monohydrate
Acta Crystallographica Section C
50(4)
(1994)
563-565 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,816 | 9.435 | 0.007 | 17.917 | 0.011 | 15.449 | 0.01 | 90 | null | 106.77 | 0.06 | 90 | null | 2,501 | 3 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | - C23 H24 Cl3 La N4 Ni O3 - | - C23 H24 Cl3 La N4 Ni O3 - | - C92 H96 Cl12 La4 N16 Ni4 O12 - | 4 | 1 | Jerzy Lisowski; Przemysław Starynowicz | Heterodinuclear Macrocyclic Complexes Containing Both Nickel(II) and Lanthanide(III) Ions | Inorganic Chemistry | 1,999 | 38 | 1351 | 1355 | 10.1021/ic971416p | 0.71073 | MoKα | 0.0422 | 0.0299 | null | 0.0645 | 0.0627 | null | null | null | 2.574 | 2.749 | 2.749 | null | null | null | has coordinates,has disorder | Jerzy Lisowski; Przemysław Starynowicz
Heterodinuclear Macrocyclic Complexes Containing Both Nickel(II) and Lanthanide(III) Ions
Inorganic Chemistry
38
(1999)
1351-1355 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,580 | 12.341 | 0.002 | 19.58 | 0.002 | 11.464 | 0.003 | 90 | null | 113.5 | 0.02 | 90 | null | 2,540.4 | 0.9 | 298 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | null | - C54 H50 Au2 Cl2 N2 P4 - | - C54 H50 Au2 Cl2 N2 P4 - | - C108 H100 Au4 Cl4 N4 P8 - | 2 | 0.5 | AL1054 | Liou, L.-S.; Liu, C.-P.; Wang, J.-C. | The monoclinic phase [Au~2~(C~25~H~22~P~2~)~2~]Cl~2~.2CH~3~CN | Acta Crystallographica Section C | 1,994 | 50 | 4 | 538 | 540 | 10.1107/S0108270193009308 | 0.71073 | MoKα | null | 0.0362 | null | null | 0.0433 | null | null | null | null | 0.61 | 0.61 | null | null | null | has coordinates | Liou, L.-S.; Liu, C.-P.; Wang, J.-C.
The monoclinic phase [Au~2~(C~25~H~22~P~2~)~2~]Cl~2~.2CH~3~CN
Acta Crystallographica Section C
50(4)
(1994)
538-540 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,581 | 13.608 | 0.008 | 8.998 | 0.006 | 15.334 | 0.008 | 90 | null | 118.61 | 0.04 | 90 | null | 1,648.3 | 1.8 | 296 | null | null | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - C10 H10 N2 S6 Zn - | - C10 H10 N2 S6 Zn - | - C40 H40 N8 S24 Zn4 - | 4 | 0.5 | AL1062 | Li, Hongjun; Du, Shaowu; Wu, Xintao | (Hexasulfanediyl)di(pyridine-<i>N</i>)zinc | Acta Crystallographica Section C | 1,994 | 50 | 4 | 498 | 500 | 10.1107/S0108270193010868 | 0.71069 | MoKα | null | 0.05 | null | null | 0.059 | null | null | null | null | 1.57 | 1.57 | null | null | null | has coordinates | Li, Hongjun; Du, Shaowu; Wu, Xintao
(Hexasulfanediyl)di(pyridine-<i>N</i>)zinc
Acta Crystallographica Section C
50(4)
(1994)
498-500 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,582 | 13.844 | 0.004 | 25.734 | 0.01 | 9.59 | 0.002 | 90 | null | 107.58 | 0.02 | 90 | null | 3,257 | 1.8 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | null | - C36 H42 N2 O4 Yb - | - C36 H42 N2 O4 Yb - | - C144 H168 N8 O16 Yb4 - | 4 | 1 | AL1064 | Abrahams, C.T.; Deacon, G.B.; Gatehouse, B.M.; Ward, G.N. | <i>cis</i>-Bis(9-carbazolyl)(1,2-dimethoxyethane)-<i>cis</i>-bis(tetrahydrofuran)ytterbium(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 504 | 507 | 10.1107/S010827019300931X | 0.7107 | MoKᾱ | null | 0.0775 | null | null | 0.0626 | null | null | null | null | 2.48 | 2.48 | null | null | null | has coordinates | Abrahams, C.T.; Deacon, G.B.; Gatehouse, B.M.; Ward, G.N.
<i>cis</i>-Bis(9-carbazolyl)(1,2-dimethoxyethane)-<i>cis</i>-bis(tetrahydrofuran)ytterbium(II)
Acta Crystallographica Section C
50(4)
(1994)
504-507 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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2,009,583 | 14.599 | 0.001 | 14.919 | 0.004 | 18.756 | 0.003 | 90 | null | 90 | null | 90 | null | 4,085.1 | 1.3 | 298 | 3 | null | null | null | null | null | null | 6 | P c a b | -P 2bc 2ac | 61 | - C11 H29 Cl2 Cu N5 O8 - | - C11 H29 Cl2 Cu N5 O8 - | - C88 H232 Cl16 Cu8 N40 O64 - | 8 | 1 | AS1059 | Tahirov, T.H.; Lu, T.-H.; Liu, Y.-L.; Chung, C.-S. | [(2<i>RS</i>,5<i>SR</i>,8<i>SR</i>,12<i>SR</i>,15<i>SR</i>)-2,5,8,12,15-Pentaazahexadecane-κ^5^<i>N</i>^2,5,8,12,15^]copper(II) diperchlorate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 514 | 516 | 10.1107/S0108270193009783 | 0.7107 | MoKα | null | 0.062 | null | null | 0.058 | null | null | null | null | 0.95 | 0.95 | null | null | null | has coordinates,has disorder | Tahirov, T.H.; Lu, T.-H.; Liu, Y.-L.; Chung, C.-S.
[(2<i>RS</i>,5<i>SR</i>,8<i>SR</i>,12<i>SR</i>,15<i>SR</i>)-2,5,8,12,15-Pentaazahexadecane-κ^5^<i>N</i>^2,5,8,12,15^]copper(II) diperchlorate
Acta Crystallographica Section C
50(4)
(1994)
514-516 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,584 | 8.491 | 0.004 | 14.679 | 0.004 | 16.827 | 0.003 | 90 | null | 90 | null | 90 | null | 2,097.3 | 1.2 | 298 | 3 | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C12 H30 Cl2 N4 Ni O8 - | - C12 H30 Cl2 N4 Ni O8 - | - C48 H120 Cl8 N16 Ni4 O32 - | 4 | 1 | AS1060 | Tahirov, T.H.; Lu, T.-H.; Shu, K.; Chung, C.-S. | [(4<i>RS</i>,7<i>SR</i>,11<i>RS</i>)-4,12-Dimethyl-4,7,11-triazatridecylamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) diperchlorate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 516 | 518 | 10.1107/S0108270193009795 | 0.71073 | MoKα | null | 0.055 | null | null | 0.054 | null | null | null | null | 0.59 | 0.59 | null | null | null | has coordinates | Tahirov, T.H.; Lu, T.-H.; Shu, K.; Chung, C.-S.
[(4<i>RS</i>,7<i>SR</i>,11<i>RS</i>)-4,12-Dimethyl-4,7,11-triazatridecylamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) diperchlorate
Acta Crystallographica Section C
50(4)
(1994)
516-518 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,585 | 13.297 | 0.001 | 13.804 | 0.001 | 10.136 | 0.001 | 90 | null | 91.05 | 0.01 | 90 | null | 1,860.2 | 0.3 | 298 | 3 | null | null | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C10 H26 Cl2 Cu N4 O8 - | - C10 H26 Cl2 Cu N4 O13 - | - C40 H104 Cl8 Cu4 N16 O52 - | 4 | 1 | AS1066 | Tahirov, T. H.; Lu, T.-H.; Shu, K.; Chung, C.-S. | (5,5-Dimethyl-4,7-diazadecane-1,10-diamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')(perchlorato-<i>O</i>)copper(II) perchlorate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 512 | 514 | 10.1107/S010827019300959X | 0.7107 | MoKα | null | 0.039 | null | null | 0.039 | null | null | null | null | 0.54 | 0.54 | null | null | null | has coordinates | Tahirov, T. H.; Lu, T.-H.; Shu, K.; Chung, C.-S.
(5,5-Dimethyl-4,7-diazadecane-1,10-diamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')(perchlorato-<i>O</i>)copper(II) perchlorate
Acta Crystallographica Section C
50(4)
(1994)
512-514 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,586 | 8.743 | 0.002 | 9.656 | 0.001 | 12.088 | 0.003 | 89.66 | 0.02 | 77.03 | 0.02 | 73.28 | 0.01 | 950.5 | 0.4 | 298 | 3 | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C12 H28 Cl2 Cu N4 O8 - | - C12 H28 Cl2 Cu N4 O8 - | - C24 H56 Cl4 Cu2 N8 O16 - | 2 | 1 | AS1069 | Tahirov, T.H.; Lu, T.-H.; Shu, K.; Chung, C.-S. | [<i>N</i>,<i>N</i>'-Bis(3-aminopropyl)-<i>trans</i>-1,2-cyclohexanediamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']di(perchlorato-<i>O</i>)copper(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 518 | 520 | 10.1107/S0108270193010005 | 0.7093 | MoKα | null | 0.032 | null | null | 0.032 | null | null | null | null | 0.53 | 0.53 | null | null | null | has coordinates | Tahirov, T.H.; Lu, T.-H.; Shu, K.; Chung, C.-S.
[<i>N</i>,<i>N</i>'-Bis(3-aminopropyl)-<i>trans</i>-1,2-cyclohexanediamine-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']di(perchlorato-<i>O</i>)copper(II)
Acta Crystallographica Section C
50(4)
(1994)
518-520 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,815 | 11.604 | 0.007 | 11.366 | 0.007 | 15.736 | 0.004 | 90 | null | 92.84 | 0.03 | 90 | null | 2,072.9 | 1.9 | 23 | null | 23 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C24 H32 Cd4 N8 O8 S8 - | - C23 H32 Cd3 N8 O8 S8 - | - C46 H64 Cd6 N16 O16 S16 - | 2 | 0.5 | Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo | Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively | Inorganic Chemistry | 1,999 | 38 | 886 | 892 | 10.1021/ic980387v | 0.7107 | MoKα | null | 0.03 | null | null | 0.031 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo
Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively
Inorganic Chemistry
38
(1999)
88... | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
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2,009,587 | 6.79 | 0.001 | 17.238 | 0.001 | 12.464 | 0.001 | 90 | null | 91.14 | 0.01 | 90 | null | 1,458.6 | 0.3 | 298 | null | 298 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | - C14 H8 Cd N6 Ni - | - C14 H8 Cd0.5 N6 Ni0.5 - | - C56 H32 Cd2 N24 Ni2 - | 4 | 0.5 | AS1078 | Hashimoto, Masato; Iwamoto, Toschitake | Cd(2,2'-bipyridine-<i>N</i>,<i>N</i>')Ni(CN)~4~, a highly bent close two-dimensional network of [Cd-{(NC)Ni~1/4~}~4~]~<i>n~</i> | Acta Crystallographica Section C | 1,994 | 50 | 4 | 496 | 498 | 10.1107/S0108270193011126 | 0.71069 | MoKα | null | 0.036 | null | null | 0.041 | null | null | null | null | 1.42 | 1.42 | null | null | null | has coordinates | Hashimoto, Masato; Iwamoto, Toschitake
Cd(2,2'-bipyridine-<i>N</i>,<i>N</i>')Ni(CN)~4~, a highly bent close two-dimensional network of [Cd-{(NC)Ni~1/4~}~4~]~<i>n~</i>
Acta Crystallographica Section C
50(4)
(1994)
496-498 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,588 | 8.287 | 0.001 | 15.228 | 0.002 | 7.679 | 0.001 | 104.8 | 0.02 | 109.75 | 0.02 | 93.23 | 0.02 | 870.9 | 0.3 | 296 | null | null | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | endo-(1R^*^,9R^*^,10R^*^)-9,10-Dimethoxy-12,15,15- trimethyltricyclo[9.3.1.0^3,8^]pentadeca-3(8),11-diene-4,13-dione | - C20 H28 O4 - | - C20 H28 O4 - | - C40 H56 O8 - | 2 | 1 | AS1082 | Takenaka, Yasuyuki; Ono, Taizo; Uchida, Akira; Ohashi, Yuji; Furukawa, Takashi; Horiguchi, Yoshiaki; Kuwajima, Isao | <i>endo</i>-(1<i>R</i>*,9<i>R</i>*,10<i>R</i>*)-9,10-Dimethoxy-12,15,15-trimethyltricyclo[9.3.1.0^3,8^]pentadeca-3(8),11-diene-4,13-dione | Acta Crystallographica Section C | 1,994 | 50 | 4 | 556 | 558 | 10.1107/S0108270193010637 | 0.7107 | MoKα | null | 0.058 | null | null | 0.046 | null | null | null | null | 5.15 | 5.15 | null | null | null | has coordinates | Takenaka, Yasuyuki; Ono, Taizo; Uchida, Akira; Ohashi, Yuji; Furukawa, Takashi; Horiguchi, Yoshiaki; Kuwajima, Isao
<i>endo</i>-(1<i>R</i>*,9<i>R</i>*,10<i>R</i>*)-9,10-Dimethoxy-12,15,15-trimethyltricyclo[9.3.1.0^3,8^]pentadeca-3(8),11-diene-4,13-dione
Acta Crystallographica Section C
50(4)
(1994)
556-558 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,589 | 5.52 | 0.001 | 8.391 | 0.002 | 13.083 | 0.003 | 90 | null | 90.9 | 0.02 | 90 | null | 605.9 | 0.2 | 297 | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - As2 Co O7 Sr - | - As2 Co O7 Sr - | - As8 Co4 O28 Sr4 - | 4 | 1 | BR1042 | Horng, J.-C.; Wang, S.-L. | Strontium cobalt(II) diarsenate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 488 | 490 | 10.1107/S0108270193009680 | 0.71073 | MoKα | null | 0.0268 | null | null | 0.0284 | null | null | null | null | 0.92 | 0.92 | null | null | null | has coordinates | Horng, J.-C.; Wang, S.-L.
Strontium cobalt(II) diarsenate
Acta Crystallographica Section C
50(4)
(1994)
488-490 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,590 | 25.3136 | 0.0015 | 6.0161 | 0.0007 | 11.3754 | 0.0012 | 90 | null | 90 | null | 90 | null | 1,732.3 | 0.3 | 298 | null | null | null | null | null | null | null | 4 | P b c n | -P 2n 2ab | null | - C6 H12 N2 Pt - | - C6 H6 N2 Pt - | - C48 H48 N16 Pt8 - | 8 | 1 | BR1043 | Dryden, N. H.; Puddephatt, R. J.; Roy, S.; Vittal, J. J. | Two forms of <i>cis</i>-dimethylbis(methyl isocyanide)platinum(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 533 | 536 | 10.1107/S010827019301025X | 1.54184 | CuKα | null | 0.0239 | null | null | 0.025 | null | null | null | null | null | null | null | null | null | has coordinates | Dryden, N. H.; Puddephatt, R. J.; Roy, S.; Vittal, J. J.
Two forms of <i>cis</i>-dimethylbis(methyl isocyanide)platinum(II)
Acta Crystallographica Section C
50(4)
(1994)
533-536 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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4,321,814 | 11.889 | 0.004 | 33.38 | 0.008 | 9.012 | 0.003 | 90 | null | 90 | null | 90 | null | 3,576.5 | 1.9 | 297 | null | 297 | null | null | null | null | null | synthesis | 4 | C m c 21 | C 2c -2 | 36 | N,N,N',N'-tetramethylethylenediamine/copper(I) cyanide complex | - C8 H16 Cu2 N4 - | - C8 H16 Cu2 N4 - | - C96 H192 Cu24 N48 - | 12 | 1.5 | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton | Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines | Inorganic Chemistry | 1,999 | 38 | 984 | 991 | 10.1021/ic970226b | 0.71073 | MoKalpha | null | 0.068 | null | null | 0.057 | null | null | null | null | 1.4 | 1.4 | null | null | null | has coordinates | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton
Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines
Inorganic Chemistry
38
(1999)
984-991 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,591 | 26.584 | 0.002 | 6.062 | 0.001 | 11.318 | 0.001 | 90 | null | 108.038 | 0.007 | 90 | null | 1,734.3 | 0.4 | 298 | null | null | null | null | null | null | null | 4 | C 1 2/c 1 | -C 2yc | null | - C6 H12 N2 Pt - | - C6 H6 N2 Pt - | - C48 H48 N16 Pt8 - | 8 | 1 | BR1043 | Dryden, N. H.; Puddephatt, R. J.; Roy, S.; Vittal, J. J. | Two forms of <i>cis</i>-dimethylbis(methyl isocyanide)platinum(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 533 | 536 | 10.1107/S010827019301025X | 0.71073 | MoKα | null | 0.0703 | null | null | 0.0715 | null | null | null | null | null | null | null | null | null | has coordinates | Dryden, N. H.; Puddephatt, R. J.; Roy, S.; Vittal, J. J.
Two forms of <i>cis</i>-dimethylbis(methyl isocyanide)platinum(II)
Acta Crystallographica Section C
50(4)
(1994)
533-536 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,592 | 4.965 | 0.001 | 18.692 | 0.004 | 9.15 | 0.001 | 90 | null | 96.1 | 0.02 | 90 | null | 844.4 | 0.3 | 150 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C10 H22 Cu N6 O7 - | - C10 H22 Cu N6 O7 - | - C20 H44 Cu2 N12 O14 - | 2 | 1 | BR1046 | Parvez, M.; Birdsall, W. J. | Diamminebis[5-methylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)dionato(1‒)-<i>N</i>^3^]copper(II) trihydrate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 540 | 542 | 10.1107/S0108270193009886 | 0.71069 | MoKα | null | 0.049 | null | null | 0.051 | null | null | null | null | 2.28 | 2.28 | null | null | null | has coordinates | Parvez, M.; Birdsall, W. J.
Diamminebis[5-methylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)dionato(1‒)-<i>N</i>^3^]copper(II) trihydrate
Acta Crystallographica Section C
50(4)
(1994)
540-542 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-30 16:30:45 +0200 (Tue, 30 Jan 2018) $
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2,009,593 | 8.0269 | 0.0003 | 8.0269 | 0.0003 | 8.0269 | 0.0003 | 90 | null | 90 | null | 90 | null | 517.18 | 0.03 | 298 | 2 | 298 | null | null | null | null | null | 5 | P -4 3 n | P -4n 2 3 | 218 | lithuim chloro beryllophosphate sodalite | Tetralithium chloro tecto-trikis(beryllatophosphate) | - Be3 Cl Li4 O12 P3 - | - Be3 Cl Li4 O12 P3 - | - Be6 Cl2 Li8 O24 P6 - | 2 | 0.083333 | BR1052 | Harrison, William T. A.; Gier, Thurman E.; Stucky, Galen D. | Two lithium chloroberyllo(phosphate/arsenate) sodalites: Li~4~Cl(BePO~4~)~3~ and Li~4~Cl(BeAsO~4~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 471 | 473 | 10.1107/S0108270193009692 | null | CopperKα | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Harrison, William T. A.; Gier, Thurman E.; Stucky, Galen D.
Two lithium chloroberyllo(phosphate/arsenate) sodalites: Li~4~Cl(BePO~4~)~3~ and Li~4~Cl(BeAsO~4~)~3~
Acta Crystallographica Section C
50(4)
(1994)
471-473 | 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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2,009,594 | 8.23685 | 0.00008 | 8.23685 | 0.00008 | 8.23685 | 0.00008 | 90 | null | 90 | null | 90 | null | 558.835 | 0.009 | 298 | 2 | 298 | null | null | null | null | null | 5 | P -4 3 n | P -4n 2 3 | 218 | lithuim chloro berylloarsenate sodalite | Tetralithium chloro tecto-trikis(beryllatoarsenate) | - As3 Be3 Cl Li4 O12 - | - As3 Be3 Cl Li4 O12 - | - As6 Be6 Cl2 Li8 O24 - | 2 | 0.083333 | BR1052 | Harrison, William T. A.; Gier, Thurman E.; Stucky, Galen D. | Two lithium chloroberyllo(phosphate/arsenate) sodalites: Li~4~Cl(BePO~4~)~3~ and Li~4~Cl(BeAsO~4~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 471 | 473 | 10.1107/S0108270193009692 | null | CopperKα | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Harrison, William T. A.; Gier, Thurman E.; Stucky, Galen D.
Two lithium chloroberyllo(phosphate/arsenate) sodalites: Li~4~Cl(BePO~4~)~3~ and Li~4~Cl(BeAsO~4~)~3~
Acta Crystallographica Section C
50(4)
(1994)
471-473 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,813 | 8.812 | 0.003 | 9.631 | 0.002 | 7.266 | 0.003 | 90 | null | 113.4 | 0.03 | 90 | null | 565.9 | 0.3 | 297 | null | 297 | null | null | null | null | null | synthesis | 4 | C 1 2/m 1 | -C 2y | 12 | copper(I) cyanide/dimethylpiperazine complex | - C8 H14 Cu2 N4 - | - C6 H18 Cu2 N6 - | - C12 H36 Cu4 N12 - | 2 | 0.25 | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton | Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines | Inorganic Chemistry | 1,999 | 38 | 984 | 991 | 10.1021/ic970226b | 0.71073 | MoKalpha | null | 0.033 | null | null | 0.039 | null | null | null | null | 1.35 | 1.35 | null | null | null | has coordinates | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton
Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines
Inorganic Chemistry
38
(1999)
984-991 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,595 | 4.524 | 0.002 | 8.526 | 0.004 | 6.64 | 0.003 | 90 | null | 102.59 | 0.03 | 90 | null | 250 | 0.2 | 298 | null | 298 | null | null | null | null | null | 3 | A 1 2/m 1 | -A 2y | 12 | β-dicobalt diphosphate | - Co2 O7 P2 - | - Co2 O7 P2 - | - Co4 O14 P4 - | 2 | 0.25 | BR1056 | El Belghitti, Alaoui; Boukhari, Ali; Holt, Elizabeth M. | β-Dicobalt pyrophosphate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 482 | 484 | 10.1107/S010827019301100X | 0.71069 | MoKα | null | 0.057 | null | null | 0.073 | null | null | null | null | 0.98 | 0.98 | null | null | null | has coordinates | El Belghitti, Alaoui; Boukhari, Ali; Holt, Elizabeth M.
β-Dicobalt pyrophosphate
Acta Crystallographica Section C
50(4)
(1994)
482-484 | 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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2,009,596 | 11.638 | 0.003 | 13.684 | 0.003 | 14.235 | 0.005 | 88.9 | 0.02 | 77.46 | 0.02 | 78.77 | 0.02 | 2,169.9 | 1.1 | 295 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C39 H32 Cl4 O6 S6 - | - C39 H32 Cl7 O6 S6 - | - C78 H64 Cl14 O12 S12 - | 2 | 1 | CD1049 | Pang, L.; Hynes, R. C.; Whitehead, M. A. | Tris(5-acetyl-3-thienyl)methane–tetrachloromethane (2/1) inclusion compound | Acta Crystallographica Section C | 1,994 | 50 | 4 | 615 | 617 | 10.1107/S0108270193009072 | 0.7093 | MoKα | null | 0.058 | null | null | 0.058 | null | null | null | null | 1.81 | 1.81 | null | null | null | has coordinates | Pang, L.; Hynes, R. C.; Whitehead, M. A.
Tris(5-acetyl-3-thienyl)methane–tetrachloromethane (2/1) inclusion compound
Acta Crystallographica Section C
50(4)
(1994)
615-617 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,009,597 | 29.368 | 0.001 | 13.378 | 0.002 | 13.186 | 0.002 | 90 | null | 111.52 | 0.01 | 90 | null | 4,819.4 | 1.1 | 294 | null | 294 | null | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | 15 | Dimethyl 3,8-diphenyl-2a,2b,8b,8c-tetrahydrocyclopropa[cd] pentaleno[1,2-b]naphthalene-2a,8c-dicarboxylate OR Dimethyl 1',4'-diphenylnaphtho[2,3-f]tricyclo[3.3.0.0^2,8^]octa- 3,6-dien-1,2-dicarboxylate | - C32 H24 O4 - | - C32 H24 O4 - | - C256 H192 O32 - | 8 | 1 | CD1057 | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James | The photolysis product of dimethyl 9,10-diphenyl-1,4-dihydro-1,4-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,994 | 50 | 4 | 581 | 583 | 10.1107/S0108270193010807 | 1.5418 | CopperKα | 0.175 | 0.068 | null | 0.102 | 0.088 | null | null | null | null | 2.3 | 2.3 | null | null | null | has coordinates | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James
The photolysis product of dimethyl 9,10-diphenyl-1,4-dihydro-1,4-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
50(4)
(1994)
581-583 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,598 | 9.772 | 0.001 | 11.034 | 0.002 | 8.174 | 0.001 | 92.58 | 0.01 | 111.5 | 0.01 | 97.96 | 0.01 | 807.7 | 0.2 | 294 | null | 294 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | Methyl 2-benzoyl-1,4-dihydro-1,4-ethenonaphthalene-3-carboxylate | - C21 H16 O3 - | - C21 H16 O3 - | - C42 H32 O6 - | 2 | 1 | CD1059 | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James; Yap, Melvin | An ethenonaphthalene and one of its photolysis products | Acta Crystallographica Section C | 1,994 | 50 | 4 | 578 | 581 | 10.1107/S0108270193010819 | 1.5418 | CuKα | 0.053 | 0.042 | null | 0.092 | 0.08 | null | null | null | null | 2.7 | 2.7 | null | null | null | has coordinates | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James; Yap, Melvin
An ethenonaphthalene and one of its photolysis products
Acta Crystallographica Section C
50(4)
(1994)
578-581 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,599 | 33.023 | 0.002 | 11.21 | 0.001 | 8.637 | 0.002 | 90 | null | 90 | null | 90 | null | 3,197.3 | 0.8 | 294 | null | 294 | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | 61 | Methyl 6c-benzoyl-2a,2b,6b,6c-tetrahydrobenzo[a]cyclopropa[cd] pentalene-6b-carboxylate OR Methyl 1-benzoylbenzo[f]tricyclo[3.3.0.0^2,8^]octa-3,6-dien- 5-carboxylate OR Methyl 3-benzoyltetracyclo[6.4.0.0^2,4^.0^3,7^]dodeca- 1(8),5,9,11-tetraen-7-carboxylate | - C21 H16 O3 - | - C21 H16 O3 - | - C168 H128 O24 - | 8 | 1 | CD1059 | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James; Yap, Melvin | An ethenonaphthalene and one of its photolysis products | Acta Crystallographica Section C | 1,994 | 50 | 4 | 578 | 581 | 10.1107/S0108270193010819 | 1.5418 | CuKα | 0.054 | 0.042 | null | 0.064 | 0.063 | null | null | null | null | 2 | 2 | null | null | null | has coordinates | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James; Yap, Melvin
An ethenonaphthalene and one of its photolysis products
Acta Crystallographica Section C
50(4)
(1994)
578-581 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,812 | 8.714 | 0.003 | 8.714 | 0.003 | 8.083 | 0.004 | 90 | null | 90 | null | 120 | null | 531.5 | 0.4 | 297 | null | 297 | null | null | null | null | null | systhesis | 4 | P 63 | P 6c | 173 | hydrogen cyanide/copper(I) cyanide/diazobicyclooctane complex | - C9 H13 Cu2 N5 - | - C9 H6 Cu2 N5 - | - C18 H12 Cu4 N10 - | 2 | 0.333333 | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton | Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines | Inorganic Chemistry | 1,999 | 38 | 984 | 991 | 10.1021/ic970226b | 0.71073 | MoKalpha | null | 0.03 | null | null | 0.038 | null | null | null | null | 1.76 | 1.76 | null | null | null | has coordinates | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton
Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines
Inorganic Chemistry
38
(1999)
984-991 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:18:08 +0200 (Wed, 23 Mar 2016) $
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2,009,600 | 10.349 | 0.001 | 16.62 | 0.001 | 8.9933 | 0.0006 | 90 | null | 90 | null | 90 | null | 1,546.9 | 0.2 | 294 | null | 294 | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | 12-Methyl 9-hydroxymethyl-9,10-dihydro-9,10-ethenoanthracene- 11,12-dicarboxylate lactone OR Methyl 3,5-dihydro-3-oxo-1H-5,9b[1',2']benzenonaphtho[1,2-c]furan- 4-carboxylate | - C20 H14 O4 - | - C20 H14 O4 - | - C80 H56 O16 - | 4 | 1 | CD1060 | Chen, Jianxin; Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James | 12-Methyl-9-hydroxymethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate lactone | Acta Crystallographica Section C | 1,994 | 50 | 4 | 576 | 578 | 10.1107/S0108270193010820 | 1.5418 | CuKα | 0.049 | 0.038 | null | 0.056 | 0.055 | null | null | null | null | 1.77 | 1.77 | null | null | null | has coordinates | Chen, Jianxin; Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James
12-Methyl-9-hydroxymethyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate lactone
Acta Crystallographica Section C
50(4)
(1994)
576-578 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,601 | 7.858 | 0.001 | 7.858 | 0.001 | 7.086 | 0.001 | 90 | null | 90 | null | 120 | null | 378.93 | 0.09 | 293 | null | 293 | null | null | null | null | null | 4 | P 63/m | -P 6c | 176 | Aluminium hydrogen phosphite | - Al2 H3 O9 P3 - | - Al2 H3 O9 P3 - | - Al4 H6 O18 P6 - | 2 | 0.166667 | CR1025 | Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K. | Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 473 | 476 | 10.1107/S0108270193009217 | 0.71069 | MoKα | 0.0177 | null | null | 0.0185 | null | null | null | null | null | null | null | null | null | null | has coordinates | Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K.
Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~
Acta Crystallographica Section C
50(4)
(1994)
473-476 | 198,601 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-10 18:33:26 +0300 (Mon, 10 Jul 2017) $
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2,009,602 | 7.91382 | 0.00006 | 7.91382 | 0.00006 | 7.24062 | 0.00007 | 90 | null | 90 | null | 120 | null | 392.716 | 0.006 | null | null | null | null | null | null | null | null | 4 | P 63/m | -P 6c | 176 | Gallium hydrogen phosphite | - Ga2 H3 O9 P3 - | - Ga2 H3 O9 P3 - | - Ga4 H6 O18 P6 - | 2 | 0.166667 | CR1025 | Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K. | Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 473 | 476 | 10.1107/S0108270193009217 | 1.54178 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | has coordinates | Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K.
Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~
Acta Crystallographica Section C
50(4)
(1994)
473-476 | 190,398 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-01-11 15:51:15 +0200 (Wed, 11 Jan 2017) $
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2,009,603 | 10.597 | 0.003 | 11.704 | 0.004 | 14.39 | 0.006 | 90 | null | 103.28 | 0.03 | 90 | null | 1,737 | 1.1 | 298 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C17 H24 Cl3 N - | - C17 H24 Cl3 N - | - C68 H96 Cl12 N4 - | 4 | 1 | CR1066 | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I. | Diastereomeric octahydronaphthoquinolizines | Acta Crystallographica Section C | 1,994 | 50 | 4 | 609 | 613 | 10.1107/S0108270193009242 | 1.54178 | CuKα | null | 0.085 | null | null | 0.08 | null | null | null | null | 2.26 | 2.26 | null | null | null | has coordinates | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I.
Diastereomeric octahydronaphthoquinolizines
Acta Crystallographica Section C
50(4)
(1994)
609-613 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,811 | 5.97 | 0.003 | 12.019 | 0.005 | 10.994 | 0.005 | 90 | 0.03 | 92.59 | 0.03 | 90 | 0.03 | 788.1 | 0.6 | 125 | 2 | 125 | 2 | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | Methyl-chloromethylidene-oxonium-hexafluoroantimonate | - C2 H4 Cl F6 O Sb - | - C2 H4 Cl F6 O Sb - | - C8 H16 Cl4 F24 O4 Sb4 - | 4 | 1 | Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam | Halogenated Carboxonium Salts: Preparation and Structural Analysis | Inorganic Chemistry | 1,999 | 38 | 844 | 847 | 10.1021/ic981212o | 0.71073 | MoKα | 0.0439 | 0.0419 | null | 0.1372 | 0.1344 | null | null | null | 1.141 | 1.146 | 1.146 | null | null | null | has coordinates | Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam
Halogenated Carboxonium Salts: Preparation and Structural Analysis
Inorganic Chemistry
38
(1999)
844-847 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,604 | 8.922 | 0.002 | 11.522 | 0.005 | 15.734 | 0.002 | 90 | null | 97.51 | 0.01 | 90 | null | 1,603.6 | 0.8 | 298 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C16 H22 Cl N O4 - | - C16 H22 Cl N O4 - | - C64 H88 Cl4 N4 O16 - | 4 | 1 | CR1066 | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I. | Diastereomeric octahydronaphthoquinolizines | Acta Crystallographica Section C | 1,994 | 50 | 4 | 609 | 613 | 10.1107/S0108270193009242 | 1.54178 | CuKα | null | 0.066 | null | null | 0.075 | null | null | null | null | 2.59 | 2.59 | null | null | null | has coordinates | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I.
Diastereomeric octahydronaphthoquinolizines
Acta Crystallographica Section C
50(4)
(1994)
609-613 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,605 | 8.427 | 0.002 | 13.509 | 0.001 | 7.467 | 0.003 | 92.06 | 0.02 | 111.18 | 0.02 | 94.11 | 0.01 | 788.8 | 0.4 | 298 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C16 H22 Cl N O4 - | - C16 H22 Cl N O4 - | - C32 H44 Cl2 N2 O8 - | 2 | 1 | CR1066 | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I. | Diastereomeric octahydronaphthoquinolizines | Acta Crystallographica Section C | 1,994 | 50 | 4 | 609 | 613 | 10.1107/S0108270193009242 | 1.54178 | CuKα | null | 0.08 | null | null | 0.103 | null | null | null | null | 3.96 | 3.96 | null | null | null | has coordinates | Cai, B.; Pan, Y.; Qiu, H.; Dewan, J. C.; Wink, D. J.; Murphy, R. B.; Schuster, D. I.
Diastereomeric octahydronaphthoquinolizines
Acta Crystallographica Section C
50(4)
(1994)
609-613 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,606 | 11.062 | 0.005 | 11.616 | 0.005 | 16.817 | 0.006 | 97.15 | 0.03 | 93.45 | 0.03 | 93.2 | 0.03 | 2,135.9 | 1.5 | 293 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C24 H20 Au P S - | - C48 H40 Au2 P2 S2 - | - C96 H80 Au4 P4 S4 - | 2 | 1 | CR1067 | Fackler, J.P.Jr.; Staples, R.J.; Elduque, A.; Grant, T. | Benzenethiolato(triphenylphosphine)gold(I) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 520 | 523 | 10.1107/S0108270193009254 | 0.71073 | MoKα | null | 0.038 | null | null | 0.0396 | null | null | null | null | 1.28 | 1.28 | null | null | null | has coordinates | Fackler, J.P.Jr.; Staples, R.J.; Elduque, A.; Grant, T.
Benzenethiolato(triphenylphosphine)gold(I)
Acta Crystallographica Section C
50(4)
(1994)
520-523 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
#$Revision: 278247 $
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2,009,607 | 37.462 | 0.002 | 6.2017 | 0.0003 | 8.1843 | 0.0004 | 90 | null | 98.891 | 0.004 | 90 | null | 1,878.6 | 0.16 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | C 1 2 1 | C 2y | 5 | cyclo-glycyl-L-phenylglycine | - C10 H10.5 N2 O2.25 - | - C10 H10.5 N2 O2.25 - | - C80 H84 N16 O18 - | 8 | 2 | CR1093 | Szkaradzinska, Maria B.; Kubicki, Maciej; Codding, Penelope W. | Two cyclic dipeptide anticonvulsants: <i>cyclo</i>-glycyl-<small>L</small>-phenylglycine (1) and <i>cyclo</i>-<small>L</small>-alanyl-<small>D</small>-phenylglycine (2) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 565 | 569 | 10.1107/S0108270193010467 | 1.54178 | CuKα | 0.0467 | 0.0444 | null | 0.1546 | 0.1287 | null | null | null | 1.066 | 1.075 | 1.075 | null | null | null | has coordinates | Szkaradzinska, Maria B.; Kubicki, Maciej; Codding, Penelope W.
Two cyclic dipeptide anticonvulsants: <i>cyclo</i>-glycyl-<small>L</small>-phenylglycine (1) and <i>cyclo</i>-<small>L</small>-alanyl-<small>D</small>-phenylglycine (2)
Acta Crystallographica Section C
50(4)
(1994)
565-569 | 201,955 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,608 | 5.0084 | 0.0006 | 20.367 | 0.003 | 5.2057 | 0.0005 | 90 | null | 105.198 | 0.008 | 90 | null | 512.44 | 0.11 | 293 | 2 | 293 | 2 | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | cyclo-L-alanyl-D-phenylglycine | - C11 H12 N2 O2 - | - C11 H12 N2 O2 - | - C22 H24 N4 O4 - | 2 | 1 | CR1093 | Szkaradzinska, Maria B.; Kubicki, Maciej; Codding, Penelope W. | Two cyclic dipeptide anticonvulsants: <i>cyclo</i>-glycyl-<small>L</small>-phenylglycine (1) and <i>cyclo</i>-<small>L</small>-alanyl-<small>D</small>-phenylglycine (2) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 565 | 569 | 10.1107/S0108270193010467 | 1.54178 | CuKα | 0.0473 | 0.0462 | null | 0.1218 | 0.1174 | null | null | null | 1.096 | 1.106 | 1.106 | null | null | null | has coordinates | Szkaradzinska, Maria B.; Kubicki, Maciej; Codding, Penelope W.
Two cyclic dipeptide anticonvulsants: <i>cyclo</i>-glycyl-<small>L</small>-phenylglycine (1) and <i>cyclo</i>-<small>L</small>-alanyl-<small>D</small>-phenylglycine (2)
Acta Crystallographica Section C
50(4)
(1994)
565-569 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,810 | 9.942 | 0.002 | 7.454 | 0.002 | 10.297 | 0.003 | 90 | 0.03 | 111.27 | 0.02 | 90 | 0.03 | 711.1 | 0.3 | 125 | 2 | 125 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | Methyl-fluoromethylidene-oxonium-hexafluoroantimonate | - C2 H4 F7 O Sb - | - C2 H4 F7 O Sb - | - C8 H16 F28 O4 Sb4 - | 4 | 1 | Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam | Halogenated Carboxonium Salts: Preparation and Structural Analysis | Inorganic Chemistry | 1,999 | 38 | 844 | 847 | 10.1021/ic981212o | 0.71073 | MoKα | 0.0516 | 0.0471 | null | 0.1515 | 0.1446 | null | null | null | 1.196 | 1.218 | 1.218 | null | null | null | has coordinates | Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam
Halogenated Carboxonium Salts: Preparation and Structural Analysis
Inorganic Chemistry
38
(1999)
844-847 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,609 | 10.302 | 0.001 | 13.96 | 0.001 | 16.64 | 0.001 | 90 | null | 90 | null | 90 | null | 2,393.1 | 0.3 | 296 | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C20 H20 Cl2 Cu N4 O8 - | - C20 H20 Cl2 Cu N4 O8 - | - C80 H80 Cl8 Cu4 N16 O32 - | 4 | 1 | DU1052 | Agnus, Y.; Labarelle, M.; Louis, R.; Metz, B. | Absolute configuration of di(perchlorato-<i>O</i>)tetra(pyridine-<i>N</i>)copper(II), [Cu(ClO~4~)~2~(py)~4~] | Acta Crystallographica Section C | 1,994 | 50 | 4 | 536 | 538 | 10.1107/S0108270193009813 | 1.5418 | CuKα | null | 0.048 | null | null | 0.047 | null | null | null | null | 1.13 | 1.13 | null | null | null | has coordinates | Agnus, Y.; Labarelle, M.; Louis, R.; Metz, B.
Absolute configuration of di(perchlorato-<i>O</i>)tetra(pyridine-<i>N</i>)copper(II), [Cu(ClO~4~)~2~(py)~4~]
Acta Crystallographica Section C
50(4)
(1994)
536-538 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,610 | 22.535 | 0.015 | 10.322 | 0.005 | 5.923 | 0.003 | 90 | null | 90 | null | 90 | null | 1,377.7 | 1.3 | 300 | 1 | 300 | 1 | null | null | null | null | 4 | P n a 21 | P 2c -2n | 33 | dipotassium hydrogenphosphate | - H K2 O4 P - | - H K2 O4 P - | - H12 K24 O48 P12 - | 12 | 3 | DU1064 | Lis, Tadeusz | Isomorphous crystals: K~2~HPO~4~ and K~5~Na(HPO~4~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 484 | 487 | 10.1107/S0108270193011023 | 0.71069 | MoKα | null | 0.032 | null | null | 0.029 | null | null | null | null | 2.08 | 2.08 | null | null | null | has coordinates | Lis, Tadeusz
Isomorphous crystals: K~2~HPO~4~ and K~5~Na(HPO~4~)~3~
Acta Crystallographica Section C
50(4)
(1994)
484-487 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,611 | 22.402 | 0.015 | 9.979 | 0.005 | 5.822 | 0.003 | 90 | null | 90 | null | 90 | null | 1,301.5 | 1.3 | 100 | 1 | 100 | 1 | null | null | null | null | 5 | P n a 21 | P 2c -2n | 33 | pentapotassium sodium trihydrogenphosphate | - H3 K5 Na O12 P3 - | - H3 K5 Na O12 P3 - | - H12 K20 Na4 O48 P12 - | 4 | 1 | DU1064 | Lis, Tadeusz | Isomorphous crystals: K~2~HPO~4~ and K~5~Na(HPO~4~)~3~ | Acta Crystallographica Section C | 1,994 | 50 | 4 | 484 | 487 | 10.1107/S0108270193011023 | 0.71069 | MoKα | null | 0.0256 | null | null | 0.0298 | null | null | null | null | 1.07 | 1.07 | null | null | null | has coordinates | Lis, Tadeusz
Isomorphous crystals: K~2~HPO~4~ and K~5~Na(HPO~4~)~3~
Acta Crystallographica Section C
50(4)
(1994)
484-487 | 288,322 | 2023-12-14 | 18:32:15 | #------------------------------------------------------------------------------
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2,009,612 | 12.509 | 0.005 | 13.139 | 0.005 | 12.197 | 0.005 | 109.77 | 0.04 | 104.77 | 0.04 | 96.42 | 0.04 | 1,780.4 | 1.4 | 293 | null | 293 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | 1,3,5-Tris[3-(2,6,6-triméthyl-1-cyclohexen-1-yl)acryloyle]benzène | - C42 H54 O3 - | - C42 H54 O3 - | - C84 H108 O6 - | 2 | 1 | DU1065 | Ginderow, Daria; Valla, Alain; Andriamialisoa, Zo; Giraud, Michel | 1,3,5-Tris[3-(2,6,6-triméthyl-1-cyclohexen-1-yl)acryloyle]benzène | Acta Crystallographica Section C | 1,994 | 50 | 4 | 574 | 576 | 10.1107/S010827019301145X | 1.5418 | radiation:CuKα | null | 0.066 | null | null | 0.063 | null | null | null | null | 3.892 | 3.892 | null | null | null | has coordinates | Ginderow, Daria; Valla, Alain; Andriamialisoa, Zo; Giraud, Michel
1,3,5-Tris[3-(2,6,6-triméthyl-1-cyclohexen-1-yl)acryloyle]benzène
Acta Crystallographica Section C
50(4)
(1994)
574-576 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,613 | 7.346 | 0.001 | 10.632 | 0.001 | 11.986 | 0.001 | 64.85 | 0.01 | 88.31 | 0.01 | 89.31 | 0.01 | 847.02 | 0.17 | 293 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C7 H13 N3 O - | - C7 H13 N3 O - | - C28 H52 N12 O4 - | 4 | 2 | GR1006 | Di Maio, G.; Li, S.; Portalone, G.; Zhou, K.; Marciante, C.; Spagna, R. | Cyclohexanone semicarbazone and 4-<i>tert</i>-butylcyclohexanone semicarbazone | Acta Crystallographica Section C | 1,994 | 50 | 4 | 635 | 638 | 10.1107/S0108270193009369 | 1.5418 | CuKα | null | 0.0399 | null | null | 0.045 | null | null | null | null | 0.1 | 0.1 | null | null | null | has coordinates | Di Maio, G.; Li, S.; Portalone, G.; Zhou, K.; Marciante, C.; Spagna, R.
Cyclohexanone semicarbazone and 4-<i>tert</i>-butylcyclohexanone semicarbazone
Acta Crystallographica Section C
50(4)
(1994)
635-638 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,809 | 13.268 | 0.001 | 29.472 | 0.001 | 18.765 | 0.001 | 90 | null | 95.93 | null | 90 | null | 7,298.5 | 0.7 | 100 | 2 | 100 | 2 | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | 14 | - C88.66 H57.66 Cl1.98 N9 O Ru - | - C88 H57 N9 O Ru - | - C352 H228 N36 O4 Ru4 - | 4 | 1 | Enzo Alessio; Silvano Geremia; Stefano Mestroni; Elisabetta Iengo; Ivana Srnova; Miroslav Slouf | Solution and Solid State Structure of a Canted, Side-to-Face, Bis(porphyrin) Adduct | Inorganic Chemistry | 1,999 | 38 | 869 | 875 | 10.1021/ic980816p | 0.8 | synchrotron | 0.0474 | 0.0392 | null | null | 0.1214 | 0.1325 | null | null | null | null | null | 1.043 | null | null | has coordinates | Enzo Alessio; Silvano Geremia; Stefano Mestroni; Elisabetta Iengo; Ivana Srnova; Miroslav Slouf
Solution and Solid State Structure of a Canted, Side-to-Face, Bis(porphyrin) Adduct
Inorganic Chemistry
38
(1999)
869-875 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,614 | 11.969 | 0.003 | 14.541 | 0.001 | 11.284 | 0.001 | 111.51 | 0.01 | 110.69 | 0.01 | 88.27 | 0.02 | 1,698.1 | 0.5 | 295 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C41 H35 N3 P2 Ru - | - C41 H35 N3 P2 Ru - | - C82 H70 N6 P4 Ru2 - | 2 | 1 | HA1048 | Taqui Khan, M.M.; Bhadbhade, M.M.; Siddiqui, M.R.H.; Venkatasubramanian, K.; Tikhonova, J.A. | Azido(η^5^-cyclopentadienyl)bis(triphenylphosphine)ruthenium(II) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 502 | 504 | 10.1107/S0108270193007425 | 1.5418 | CuKα | null | 0.038 | null | null | 0.041 | null | null | null | null | 0.51 | 0.51 | null | null | null | has coordinates | Taqui Khan, M.M.; Bhadbhade, M.M.; Siddiqui, M.R.H.; Venkatasubramanian, K.; Tikhonova, J.A.
Azido(η^5^-cyclopentadienyl)bis(triphenylphosphine)ruthenium(II)
Acta Crystallographica Section C
50(4)
(1994)
502-504 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,615 | 7.925 | 0.001 | 9.281 | 0.002 | 20.918 | 0.003 | 90 | null | 90 | null | 90 | null | 1,538.6 | 0.4 | 293 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C21 H18 O2 - | - C21 H18 O2 - | - C84 H72 O8 - | 4 | 1 | HA1052 | Pattabhi, V.; Banumathi, S.; Goverdhan, M.; Padma, S. | Cycloaddition products of tricyclo[6.2.1.0^2,7^]undeca-2(7),4,9-triene-3,6-dione | Acta Crystallographica Section C | 1,994 | 50 | 4 | 594 | 597 | 10.1107/S0108270193007814 | 1.5418 | CuKα | null | 0.068 | null | null | 0.099 | null | null | null | null | 3.25 | 3.25 | null | null | null | has coordinates | Pattabhi, V.; Banumathi, S.; Goverdhan, M.; Padma, S.
Cycloaddition products of tricyclo[6.2.1.0^2,7^]undeca-2(7),4,9-triene-3,6-dione
Acta Crystallographica Section C
50(4)
(1994)
594-597 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,616 | 6.293 | 0.001 | 28.348 | 0.001 | 7.856 | 0.001 | 90 | null | 95.29 | 0.01 | 90 | null | 1,395.5 | 0.3 | 295 | null | null | null | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | null | - C19 H16 O2 - | - C19 H16 O2 - | - C76 H64 O8 - | 4 | 1 | HA1052 | Pattabhi, V.; Banumathi, S.; Goverdhan, M.; Padma, S. | Cycloaddition products of tricyclo[6.2.1.0^2,7^]undeca-2(7),4,9-triene-3,6-dione | Acta Crystallographica Section C | 1,994 | 50 | 4 | 594 | 597 | 10.1107/S0108270193007814 | 1.5418 | CuKα | null | 0.064 | null | null | 0.063 | null | null | null | null | 2.6 | 2.6 | null | null | null | has coordinates | Pattabhi, V.; Banumathi, S.; Goverdhan, M.; Padma, S.
Cycloaddition products of tricyclo[6.2.1.0^2,7^]undeca-2(7),4,9-triene-3,6-dione
Acta Crystallographica Section C
50(4)
(1994)
594-597 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,617 | 7.4731 | 0.0007 | 10.8843 | 0.0008 | 9.0286 | 0.0006 | 90 | null | 112.992 | 0.007 | 90 | null | 676.04 | 0.1 | 293 | null | 293 | null | null | null | null | null | 4 | P 1 c 1 | P -2yc | 7 | 6-amino-2-methoxy-3-methyl-5-[(E)-1,2-dicarbomethoxyvinyl]pyrimidin-4-(3H)- one | - C12 H15 N3 O6 - | - C12 H15 N3 O6 - | - C24 H30 N6 O12 - | 2 | 1 | HA1082 | Low, John N.; Egglishaw, Clare; Ferguson, George; Cobo, Justo; Garcia, Celeste; Melguizo, Manuel; Nogueras, Manuel; Sanchez, Adolfo | 6-Amino-5-[(<i>E</i>)-1,2-bis(methoxycarbonyl)vinyl]-2-methoxy-3-methylpyrimidin-4(3<i>H</i>)-one | Acta Crystallographica Section C | 1,994 | 50 | 4 | 585 | 587 | 10.1107/S0108270193011953 | 0.71067 | MoKα | 0.037 | 0.032 | null | 0.047 | 0.045 | null | null | null | null | 1.25 | 1.25 | null | null | null | has coordinates | Low, John N.; Egglishaw, Clare; Ferguson, George; Cobo, Justo; Garcia, Celeste; Melguizo, Manuel; Nogueras, Manuel; Sanchez, Adolfo
6-Amino-5-[(<i>E</i>)-1,2-bis(methoxycarbonyl)vinyl]-2-methoxy-3-methylpyrimidin-4(3<i>H</i>)-one
Acta Crystallographica Section C
50(4)
(1994)
585-587 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,808 | 12.624 | 0.004 | 14.24 | 0.02 | 27.312 | 0.003 | 92.35 | 0.03 | 91.655 | 0.015 | 90.28 | 0.05 | 4,903 | 7 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C88 H112 Cl2 N10 O2 P2 Pt4 - | - C88 H108 Cl2 N10 O2 P2 Pt4 - | - C176 H216 Cl4 N20 O4 P4 Pt8 - | 2 | 1 | Tianle Zhang; Marc Drouin; Pierre D. Harvey | Preparation, Characterization, and Luminescence Properties of a 58-Electron Linear Pt4 Cluster, [Pt4(dmb)4(PPh3)2]2+ (dmb = 1,8-Diisocyano-p-menthane), and Its Diphosphine Polymers | Inorganic Chemistry | 1,999 | 38 | 957 | 963 | 10.1021/ic9807947 | 1.5406 | CuKa | 0.0822 | 0.0738 | null | null | 0.2097 | 0.2199 | null | null | null | null | null | 1.018 | null | null | has coordinates,has disorder | Tianle Zhang; Marc Drouin; Pierre D. Harvey
Preparation, Characterization, and Luminescence Properties of a 58-Electron Linear Pt4 Cluster, [Pt4(dmb)4(PPh3)2]2+ (dmb = 1,8-Diisocyano-p-menthane), and Its Diphosphine Polymers
Inorganic Chemistry
38
(1999)
957-963 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,618 | 9.301 | 0.002 | 12.468 | 0.004 | 10.72 | 0.003 | 90 | null | 99.48 | 0.02 | 90 | null | 1,226.2 | 0.6 | 293 | null | null | null | null | null | null | null | 6 | P 1 21/a 1 | -P 2yab | null | - C18 H26 Cl2 Cu2 N4 O10 - | - C18 H26 Cl2 Cu2 N4 O10 - | - C36 H52 Cl4 Cu4 N8 O20 - | 2 | 0.5 | HE1005 | Mukherjee, M.; Mukherjee, A. K.; Datta, S. J.; Nanda, K. K.; Helliwell, M. | A dinuclear copper(II) complex [Cu~2~<i>L</i>~2~](ClO~4~)~2~ derived from 2,6-bis(aminomethyl)-4-methylphenol (H<i>L</i>) | Acta Crystallographica Section C | 1,994 | 50 | 4 | 542 | 544 | 10.1107/S0108270193010121 | 1.5418 | CuKα | null | 0.046 | null | null | 0.052 | null | null | null | null | 1.01 | 1.01 | null | null | null | has coordinates | Mukherjee, M.; Mukherjee, A. K.; Datta, S. J.; Nanda, K. K.; Helliwell, M.
A dinuclear copper(II) complex [Cu~2~<i>L</i>~2~](ClO~4~)~2~ derived from 2,6-bis(aminomethyl)-4-methylphenol (H<i>L</i>)
Acta Crystallographica Section C
50(4)
(1994)
542-544 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,619 | 6.192 | 0.001 | 13.99 | 0.001 | 16.883 | 0.002 | 90 | null | 90 | null | 90 | null | 1,462.5 | 0.3 | 292 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C18 H20 O3 - | - C18 H20 O3 - | - C72 H80 O12 - | 4 | 1 | HH1077 | Czerwinski, E.W.; Cao, Z.; Liehr, J. | 3,8α-Dihydroxyestra-1,3,5(10),6-tetraen-17-one | Acta Crystallographica Section C | 1,994 | 50 | 4 | 601 | 603 | 10.1107/S0108270193007036 | 1.5418 | CuKα | null | 0.067 | null | null | 0.066 | null | null | null | null | 1.006 | 1.006 | null | null | null | has coordinates | Czerwinski, E.W.; Cao, Z.; Liehr, J.
3,8α-Dihydroxyestra-1,3,5(10),6-tetraen-17-one
Acta Crystallographica Section C
50(4)
(1994)
601-603 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,620 | 8.231 | 0.004 | 8.792 | 0.005 | 23.6 | 0.02 | 90 | null | 90 | null | 90 | null | 1,707.9 | 1.9 | 297 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C16 H22 O9 - | - C16 H22 O9 - | - C64 H88 O36 - | 4 | 1 | HL1037 | Lee, C.K.; Koh, L.L. | 2,2'-Di-<i>O</i>-acetyl-3,6;3',6'-dianhydro-4,4'-dideoxy-α,α-trehalose | Acta Crystallographica Section C | 1,994 | 50 | 4 | 597 | 601 | 10.1107/S0108270193008534 | 0.71069 | MoKα | null | 0.0597 | null | null | 0.0537 | null | null | null | null | 1.31 | 1.31 | null | null | null | has coordinates | Lee, C.K.; Koh, L.L.
2,2'-Di-<i>O</i>-acetyl-3,6;3',6'-dianhydro-4,4'-dideoxy-α,α-trehalose
Acta Crystallographica Section C
50(4)
(1994)
597-601 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,621 | 12.463 | 0.003 | 7.7459 | 0.0017 | 7.6212 | 0.0016 | 90 | null | 90 | null | 90 | null | 735.7 | 0.3 | 291 | 2 | null | null | null | null | null | null | 4 | P n m a | -P 2ac 2n | 62 | - C6 H10 O2 S - | - C6 H10 O2 S - | - C24 H40 O8 S4 - | 4 | 0.5 | HL1038 | Gainsford, G.J.; Woolhouse, A.D. | 2-<i>n</i>-Propylthiete sulfone | Acta Crystallographica Section C | 1,994 | 50 | 4 | 606 | 607 | 10.1107/S0108270193008947 | 0.7093 | MoKα~1~ | null | 0.035 | null | null | 0.046 | null | null | null | null | 1.627 | 1.627 | null | null | null | has coordinates | Gainsford, G.J.; Woolhouse, A.D.
2-<i>n</i>-Propylthiete sulfone
Acta Crystallographica Section C
50(4)
(1994)
606-607 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,622 | 8.235 | 0.003 | 11.152 | 0.004 | 18.442 | 0.005 | 100.6 | 0.03 | 102.1 | 0.02 | 96.89 | 0.03 | 1,605.5 | 1 | 298 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C34 H39 Cl Fe2 I3 - | - C32 H34 Cl Fe2 I3 - | - C64 H68 Cl2 Fe4 I6 - | 2 | 1 | HU1046 | Dong, T.-H.; Huang, C.-H. | Structural characterization of mixed valence 1',2',1''',2'''-tetraethylbiferrocenium triiodide | Acta Crystallographica Section C | 1,994 | 50 | 4 | 546 | 549 | 10.1107/S0108270193010169 | 0.7107 | MoKα | null | 0.048 | null | null | 0.049 | null | null | null | null | 1.52 | 1.52 | null | null | null | has coordinates | Dong, T.-H.; Huang, C.-H.
Structural characterization of mixed valence 1',2',1''',2'''-tetraethylbiferrocenium triiodide
Acta Crystallographica Section C
50(4)
(1994)
546-549 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,623 | 16.382 | 0.008 | 16.796 | 0.007 | 10.926 | 0.003 | 90 | null | 90 | null | 90 | null | 3,006 | 2 | 293 | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C31 H32 Cl2 O2 P2 Pt - | - C31 H32 Cl2 O2 P2 Pt - | - C124 H128 Cl8 O8 P8 Pt4 - | 4 | 1 | HU1050 | Ganter, C.; Orpen, A.G.; Bergamini, P.; Costa, E. | A new orthorhombic crystal form of dichloro[(‒)-(<i>R</i>,<i>R</i>)-2,2-dimethyl-4,5-bis(diphenylphosphinomethyl)-1,3-dioxolane-<i>P</i>,<i>P</i>']platinum, [{(<i>R</i>,<i>R</i>)-diop}PtCl~2~] | Acta Crystallographica Section C | 1,994 | 50 | 4 | 507 | 510 | 10.1107/S0108270193010170 | 0.71073 | MoKα | null | 0.063 | null | null | 0.056 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Ganter, C.; Orpen, A.G.; Bergamini, P.; Costa, E.
A new orthorhombic crystal form of dichloro[(‒)-(<i>R</i>,<i>R</i>)-2,2-dimethyl-4,5-bis(diphenylphosphinomethyl)-1,3-dioxolane-<i>P</i>,<i>P</i>']platinum, [{(<i>R</i>,<i>R</i>)-diop}PtCl~2~]
Acta Crystallographica Section C
50(4)
(1994)
507-510 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,807 | 5.579 | 0.001 | 13.918 | 0.001 | 18.737 | 0.002 | 111.41 | null | 96.55 | 0.01 | 91.12 | 0.01 | 1,342.7 | 0.3 | 183 | 2 | 183 | 2 | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C4 H11 B N2 - | - C4 H11 B N2 - | - C32 H88 B8 N16 - | 8 | 4 | Wendy C. Andersen; Daniel R. Mitchell; Kenneth J. H. Young; Xianhui Bu; Vincent M. Lynch; Hermann A. Mayer; William C. Kaska | The Synthesis, X-ray Crystal Structure, and Molecular Structure of Rhenium Tetra-carbonylbromidetrimethylamineisocyanoborane | Inorganic Chemistry | 1,999 | 38 | 1024 | 1027 | 10.1021/ic980697d | 0.71073 | MoKα | 0.3054 | 0.094 | null | 0.19 | 0.1146 | null | null | null | 1.018 | 1.374 | 1.374 | null | null | null | has coordinates | Wendy C. Andersen; Daniel R. Mitchell; Kenneth J. H. Young; Xianhui Bu; Vincent M. Lynch; Hermann A. Mayer; William C. Kaska
The Synthesis, X-ray Crystal Structure, and Molecular Structure of Rhenium Tetra-carbonylbromidetrimethylamineisocyanoborane
Inorganic Chemistry
38
(1999)
1024-1027 | 301,838 | 2025-08-20 | 22:17:34 | #------------------------------------------------------------------------------
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2,009,624 | 13.808 | 0.006 | 19.764 | 0.006 | 11.696 | 0.004 | 99.27 | 0.03 | 107.08 | 0.03 | 88.12 | 0.03 | 3,011 | 2 | 296 | null | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C58 H55 Cu3 O3 P4 S5 W - | - C58 H55 Cu3 O3 P4 S5 W - | - C116 H110 Cu6 O6 P8 S10 W2 - | 2 | 1 | HU1053 | Du, S.; Wu, X. | μ-(<i>O</i>,<i>O</i>'-Diethyl dithiophosphato-2κ<i>S</i>:3κ<i>S</i>')-oxo-1κ<i>O</i>-tri-μ~3~-sulfido-1:2:3κ^3^<i>S</i>;1:2:4κ^3^<i>S</i>;1:3:4κ^3^<i>S</i>-tris(triphenylphosphine)-2κ<i>P</i>;3κ<i>P</i>;4κ<i>P</i>-tricoppertungsten | Acta Crystallographica Section C | 1,994 | 50 | 4 | 500 | 502 | 10.1107/S0108270193009023 | 0.71069 | MoKα | null | 0.045 | null | null | 0.063 | null | null | null | null | 1.58 | 1.58 | null | null | null | has coordinates | Du, S.; Wu, X.
μ-(<i>O</i>,<i>O</i>'-Diethyl dithiophosphato-2κ<i>S</i>:3κ<i>S</i>')-oxo-1κ<i>O</i>-tri-μ~3~-sulfido-1:2:3κ^3^<i>S</i>;1:2:4κ^3^<i>S</i>;1:3:4κ^3^<i>S</i>-tris(triphenylphosphine)-2κ<i>P</i>;3κ<i>P</i>;4κ<i>P</i>-tricoppertungsten
Acta Crystallographica Section C
50(4)
(1994)
500-502 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,625 | 9.525 | 0.008 | 12.936 | 0.009 | 25.831 | 0.009 | 78.16 | 0.04 | 83.79 | 0.04 | 72.26 | 0.05 | 2,963 | 4 | 296 | null | 296 | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | Exo,exo-17-(3,3,3-trifluro-2-trifluoromethyl-1-azapropenyl)- 4,4,12,12,16,16-hexakis(trifluoromethyl)-3,11,17-triazaheptacyclo [12.4.1.1.^6,9^.0^2,13^.0^3,11^ 0^5,10^.0^15,18^]eicos-7-ene | - C26 H16 F24 N4 - | - C26 H16 F25.5 N4 - | - C104 H64 F102 N16 - | 4 | 2 | HU1061 | Barlow, M.G.; Pritchard, R.G.; Suliman, N.S.; Tipping, A.E. | <i>exo</i>,<i>exo</i>-4,4,12,12,16,16-Hexakis(trifluoromethyl)-17-(3,3,3-trifluoro-2-trifluoromethyl-1-azapropenyl)-3,11,17-triazaheptacyclo[12.4.1.1^6,9^.0^2,13^.0^3,11^.0^5,10^.0^15,18^]icos-7-ene formed <i>via</i> novel 1,3-dipolar cycloaddition to quadricyclane | Acta Crystallographica Section C | 1,994 | 50 | 4 | 553 | 556 | 10.1107/S0108270193009011 | 0.71069 | MoKα | null | 0.0501 | null | null | 0.0396 | null | null | null | null | 2.111 | 2.111 | null | null | null | has coordinates | Barlow, M.G.; Pritchard, R.G.; Suliman, N.S.; Tipping, A.E.
<i>exo</i>,<i>exo</i>-4,4,12,12,16,16-Hexakis(trifluoromethyl)-17-(3,3,3-trifluoro-2-trifluoromethyl-1-azapropenyl)-3,11,17-triazaheptacyclo[12.4.1.1^6,9^.0^2,13^.0^3,11^.0^5,10^.0^15,18^]icos-7-ene formed <i>via</i> novel 1,3-dipolar cycloaddition to quadricy... | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,626 | 8.637 | 0.002 | 14.976 | 0.003 | 13.714 | 0.003 | 90 | null | 94.39 | 0.02 | 90 | null | 1,768.7 | 0.7 | 296 | null | 296 | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | 4,5:9,10-Dibenzo-1,7-dichloro-1,7-(14-chloromethanonitrilo) tetracyclo[5.5.2.0.^2,6^0^8,12^]tetradec-13-ene | - C21 H16 Cl3 N - | - C21 H16 Cl3 N - | - C84 H64 Cl12 N4 - | 4 | 1 | HU1062 | Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E. | 4,5:9,10-Dibenzo-1,7-dichloro-1,7-(14-chloromethanonitrilo)tetracyclo[5.5.2.0^2,6^.0^8,12^]tetradec-13-ene, a 2:1 Diels–Alder cycloaddition product of indene and 3,5,6-trichloro-1,2,4-triazine | Acta Crystallographica Section C | 1,994 | 50 | 4 | 552 | 553 | 10.1107/S0108270193010959 | 0.71069 | MoKα | null | 0.0443 | null | null | 0.0494 | null | null | null | null | 1.627 | 1.627 | null | null | null | has coordinates | Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E.
4,5:9,10-Dibenzo-1,7-dichloro-1,7-(14-chloromethanonitrilo)tetracyclo[5.5.2.0^2,6^.0^8,12^]tetradec-13-ene, a 2:1 Diels–Alder cycloaddition product of indene and 3,5,6-trichloro-1,2,4-triazine
Acta Crystallographica Section C
50(4)
(1994)
552-553 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,627 | 6.241 | 0.002 | 12.296 | 0.003 | 12.758 | 0.004 | 90 | null | 95.58 | 0.02 | 90 | null | 974.4 | 0.5 | 296 | null | 296 | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | 1,7-Dichloro-9-azatricyclo[4.3.1.0^3,7^]decan-8-one | - C9 H11 Cl2 N O - | - C9 H11 Cl2 N O - | - C36 H44 Cl8 N4 O4 - | 4 | 1 | HU1063 | Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E. | 1,7-Dichloro-9-azatricyclo[4.3.1.0^3,7^]decan-8-one, a hydrolysed Diels–Alder cycloaddition product from the reaction of 3,5,6-trichloro-1,2,4-triazine with hexa-1,5-diene | Acta Crystallographica Section C | 1,994 | 50 | 4 | 550 | 551 | 10.1107/S0108270193010960 | 0.71069 | MoKα | null | 0.0478 | null | null | 0.0602 | null | null | null | null | 2.057 | 2.057 | null | null | null | has coordinates | Barlow, M. G.; Pritchard, R. G.; Sibous, L.; Tipping, A. E.
1,7-Dichloro-9-azatricyclo[4.3.1.0^3,7^]decan-8-one, a hydrolysed Diels–Alder cycloaddition product from the reaction of 3,5,6-trichloro-1,2,4-triazine with hexa-1,5-diene
Acta Crystallographica Section C
50(4)
(1994)
550-551 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,806 | 11.723 | 0.0004 | 16.5951 | 0.0006 | 27.8526 | 0.001 | 90 | null | 90 | null | 90 | null | 5,418.6 | 0.3 | 293 | 2 | 293 | 2 | null | null | null | null | 7 | P 21 21 21 | P 2ac 2ab | 19 | - C54 H56 Cl8 Fe2 N2 P2 Ru - | - C54 H56 Cl8 Fe2 N2 P2 Ru - | - C216 H224 Cl32 Fe8 N8 P8 Ru4 - | 4 | 1 | Jeong-Ho Song; Dong-Jei Cho; Sang-Jin Jeon; Yong-Hoon Kim; Tae-Jeong Kim; Jong Hwa Jeong | Synthesis of Chiral C2-Symmetric Bisferrocenyldiamines. X-ray Crystal Structure of Ru(2)Cl2.2CHCl3 (2 = N1,N2-Bis{(R)-1-[(S)-2-(diphenylphosphino)]ferrocenylethyl}- N1,N2-dimethyl-1,2-ethanediamine) | Inorganic Chemistry | 1,999 | 38 | 893 | 896 | 10.1021/ic980433r | 0.71073 | MoKα | 0.059 | 0.0548 | null | null | 0.1233 | 0.1257 | null | null | null | null | null | 1.089 | null | null | has coordinates | Jeong-Ho Song; Dong-Jei Cho; Sang-Jin Jeon; Yong-Hoon Kim; Tae-Jeong Kim; Jong Hwa Jeong
Synthesis of Chiral C2-Symmetric Bisferrocenyldiamines. X-ray Crystal Structure of Ru(2)Cl2.2CHCl3 (2 = N1,N2-Bis{(R)-1-[(S)-2-(diphenylphosphino)]ferrocenylethyl}- N1,N2-dimethyl-1,2-ethanediamine)
Inorganic Chemistry
38
(1999)
89... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,628 | 7.413 | 0.003 | 23.75 | 0.01 | 7.933 | 0.003 | 90 | null | 110.92 | 0.04 | 90 | null | 1,304.6 | 1 | 240 | 1 | 240 | 1 | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C15 H14 N2 O3 - | - C15 H14 N2 O3 - | - C60 H56 N8 O12 - | 4 | 1 | HU1068 | Clegg, William; Stanforth, Stephen P.; Hedley, K. Andrew; Raper, Eric S.; Creighton, James R. | <i>N</i>-[2-(2-Formylphenyl)ethyl]-2-nitroaniline | Acta Crystallographica Section C | 1,994 | 50 | 4 | 583 | 585 | 10.1107/S0108270193010972 | 0.71073 | MoKα | 0.1892 | 0.0637 | null | 0.2068 | 0.1443 | null | null | null | 1.033 | 1.217 | 1.217 | null | null | null | has coordinates | Clegg, William; Stanforth, Stephen P.; Hedley, K. Andrew; Raper, Eric S.; Creighton, James R.
<i>N</i>-[2-(2-Formylphenyl)ethyl]-2-nitroaniline
Acta Crystallographica Section C
50(4)
(1994)
583-585 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,629 | 31.346 | 0.001 | 26.838 | 0.006 | 7.293 | 0.005 | 90 | null | 90 | null | 90 | null | 6,135 | 4 | 300 | null | null | null | null | null | null | null | 5 | F d d 2 | F 2 -2d | null | - C11 H19 N5 O6 S - | - C11 H18 N5 O5.5 S - | - C176 H288 N80 O88 S16 - | 16 | 1 | LI1054 | Nigam, G. D.; Karak, S.; Saha, C.R.; Srinivasan, S. | A triazine derivative | Acta Crystallographica Section C | 1,994 | 50 | 4 | 613 | 614 | 10.1107/S0108270193009461 | 1.5418 | CuKα | null | 0.039 | null | null | 0.04 | null | null | null | null | null | null | null | null | null | has coordinates | Nigam, G. D.; Karak, S.; Saha, C.R.; Srinivasan, S.
A triazine derivative
Acta Crystallographica Section C
50(4)
(1994)
613-614 | 194,474 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,630 | 7.877 | 0.001 | 12.6 | 0.002 | 14.326 | 0.002 | 90 | null | 96.68 | 0.01 | 90 | null | 1,412.2 | 0.3 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C15 H12 Br N O4 - | - C15 H12 Br N O4 - | - C60 H48 Br4 N4 O16 - | 4 | 1 | LI1062 | Chandra Mohan, K.; Ravikumar, K.; Vittal, T. V. S. K.; Gido, C. K. | An intermediate in the synthesis of formoterol | Acta Crystallographica Section C | 1,994 | 50 | 4 | 627 | 629 | 10.1107/S0108270193009473 | 0.71063 | MoKα | null | 0.031 | null | null | 0.038 | null | null | null | null | 1.06 | 1.06 | null | null | null | has coordinates | Chandra Mohan, K.; Ravikumar, K.; Vittal, T. V. S. K.; Gido, C. K.
An intermediate in the synthesis of formoterol
Acta Crystallographica Section C
50(4)
(1994)
627-629 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,631 | 17.97 | 0.004 | 7.418 | 0.002 | 17.634 | 0.006 | 90 | null | 116.84 | 0.02 | 90 | null | 2,097.4 | 1.1 | 296 | null | null | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | null | - C10 H13 Cl N2 O - | - C10 H13 Cl N2 O - | - C80 H104 Cl8 N16 O8 - | 8 | 1 | LI1063 | Yang, Q.-C.; Ni, N.; Xu, X.-J.; Tang, Y.-Q. | 1-Benzyl-3-pyrazolidone hydrochloride | Acta Crystallographica Section C | 1,994 | 50 | 4 | 648 | 650 | 10.1107/S0108270193009485 | 0.71073 | MoKα | null | 0.0405 | null | null | 0.0464 | null | null | null | null | 1.74 | 1.74 | null | null | null | has coordinates | Yang, Q.-C.; Ni, N.; Xu, X.-J.; Tang, Y.-Q.
1-Benzyl-3-pyrazolidone hydrochloride
Acta Crystallographica Section C
50(4)
(1994)
648-650 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,632 | 6.98 | 0.02 | 29.76 | 0.02 | 12.491 | 0.007 | 90 | null | 90 | null | 90 | null | 2,595 | 8 | 298 | null | null | null | null | null | null | null | 4 | P b c a | -P 2ac 2ab | null | - C17 H9 N S - | - C17 H8 N S - | - C136 H64 N8 S8 - | 8 | 1 | LI1064 | Barrow, M. J.; Milburn, G. H. W.; Zeng, Z.; Sarkar, A.; Talwar, S. S. | 1-(3-Quinolyl)-4-(2-thienyl)-1,3-butadiyne, C~17~H~9~NS | Acta Crystallographica Section C | 1,994 | 50 | 4 | 650 | 652 | 10.1107/S0108270193009497 | 0.7107 | MoKα | null | 0.064 | null | null | 0.065 | null | null | null | null | null | null | null | null | null | has coordinates | Barrow, M. J.; Milburn, G. H. W.; Zeng, Z.; Sarkar, A.; Talwar, S. S.
1-(3-Quinolyl)-4-(2-thienyl)-1,3-butadiyne, C~17~H~9~NS
Acta Crystallographica Section C
50(4)
(1994)
650-652 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,633 | 11.902 | 0.006 | 11.952 | 0.005 | 9.38 | 0.006 | 90 | null | 90 | null | 90 | null | 1,334 | 1 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 21 c n | P -2n 2a | 33 | trans,syn,cis-1-acetoxytricyclo[7.4.0.0^2,7^]tridecan-8-one | - C15 H22 O3 - | - C15 H22 O3 - | - C60 H88 O12 - | 4 | 1 | LI1073 | Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P. | Stereochemistry of transposition reactions involving polycyclic methylenecyclobutanol derivatives | Acta Crystallographica, Section C: Crystal Structure Communications | 1,994 | 50 | 4 | 569 | 574 | 10.1107/s0108270193010601 | 0.7093 | MoKα~1~ | 0.0445 | 0.0245 | null | null | 0.0471 | null | null | null | 0.852 | 0.976 | 0.976 | null | null | null | has coordinates | Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P.
Stereochemistry of transposition reactions involving polycyclic methylenecyclobutanol derivatives
Acta Crystallographica, Section C: Crystal Structure Communications
50(4)
(1994)
569-574 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,805 | 16.297 | 0.003 | 26.267 | 0.003 | 16.296 | 0.002 | 90 | null | 90.2 | 0.01 | 90 | null | 6,975.8 | 1.7 | 298 | null | 23 | null | null | null | null | null | 6 | C 1 2/c 1 | -C 2yc | 15 | - C22 H32 Cd3 N6 O8 S6 - | - C22 H32 Cd3 N6 O8 S6 - | - C176 H256 Cd24 N48 O64 S48 - | 8 | 1 | Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo | Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively | Inorganic Chemistry | 1,999 | 38 | 886 | 892 | 10.1021/ic980387v | 0.7107 | MoKalpha | null | 0.039 | null | null | 0.041 | null | null | null | null | 2.97 | 2.97 | null | null | null | has coordinates | Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo
Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively
Inorganic Chemistry
38
(1999)
88... | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,634 | 10.769 | 0.002 | 15.185 | 0.002 | 15.849 | 0.002 | 90 | null | 90.06 | 0.01 | 90 | null | 2,591.7 | 0.7 | 293 | 2 | 293 | 2 | null | null | null | null | 3 | P 1 21/c 1 | -P 2ybc | 14 | cis,anti,cis-1-acetoxy-7-hydroxytricyclo[7.3.0.0^2,7^]dodecan-8-one | - C14 H20 O4 - | - C14 H20 O4 - | - C112 H160 O32 - | 8 | 2 | LI1073 | Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P. | Stereochemistry of transposition reactions involving polycyclic methylenecyclobutanol derivatives | Acta Crystallographica, Section C: Crystal Structure Communications | 1,994 | 50 | 4 | 569 | 574 | 10.1107/s0108270193010601 | 1.54056 | CuKα~1~ | 0.0966 | 0.0472 | null | 0.1265 | 0.1238 | null | null | null | 0.817 | 0.989 | 0.989 | null | null | null | has coordinates | Ianelli, S.; Nardelli, M.; Belletti, D.; Brosse, N.; Jamart-Grégoire, B.; Caubère, P.
Stereochemistry of transposition reactions involving polycyclic methylenecyclobutanol derivatives
Acta Crystallographica, Section C: Crystal Structure Communications
50(4)
(1994)
569-574 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,635 | 6.029 | 0.001 | 7.708 | 0.001 | 30.468 | 0.005 | 90 | null | 94.84 | 0.02 | 90 | null | 1,410.8 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/n 1 | -P 2yn | 14 | - C17 H15 N O3 - | - C17 H15 N O3 - | - C68 H60 N4 O12 - | 4 | 1 | MU1049 | Ravikumar, K. | Non-steroidal anti-inflammatory drugs. III. Structure of indoprofen: 2-[4-(1-oxo-2-isoindolinyl)phenyl]propionic acid | Acta Crystallographica Section C | 1,994 | 50 | 4 | 589 | 592 | 10.1107/S0108270193007450 | 0.71069 | MoKα | null | 0.062 | null | null | 0.069 | null | null | null | null | 1.08 | 1.08 | null | null | null | has coordinates | Ravikumar, K.
Non-steroidal anti-inflammatory drugs. III. Structure of indoprofen: 2-[4-(1-oxo-2-isoindolinyl)phenyl]propionic acid
Acta Crystallographica Section C
50(4)
(1994)
589-592 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,636 | 6.89 | 0.002 | 15.798 | 0.004 | 27.201 | 0.007 | 90 | null | 90 | null | 90 | null | 2,960.8 | 1.4 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | 19 | - C16 H11 N3 O4 - | - C16 H11 N3 O4 - | - C128 H88 N24 O32 - | 8 | 2 | NA1042 | Özbey, S.; Kendi̇, E.; Hocaoglu, N.; Uyar, T.; Mak, T. C. W.; Cascarano, G. L. | 2-Methyl-2-(4-nitrophenylazo)-1,3-indandione, C~16~H~11~N~3~O~4~ | Acta Crystallographica, Section C: Crystal Structure Communications | 1,994 | 50 | 4 | 629 | 631 | 10.1107/S0108270193009862 | 0.7107 | MoKα | null | 0.043 | null | null | 0.039 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Özbey, S.; Kendi̇, E.; Hocaoglu, N.; Uyar, T.; Mak, T. C. W.; Cascarano, G. L.
2-Methyl-2-(4-nitrophenylazo)-1,3-indandione, C~16~H~11~N~3~O~4~
Acta Crystallographica, Section C: Crystal Structure Communications
50(4)
(1994)
629-631 | 291,314 | 2024-04-22 | 13:06:42 | #------------------------------------------------------------------------------
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2,009,637 | 18.145 | 0.001 | 10.364 | 0.004 | 21.596 | 0.004 | 90 | null | 90 | null | 90 | null | 4,061.2 | 1.8 | 293 | null | null | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | null | - C21 H24 I N O3 - | - C21 H24 I N O3 - | - C168 H192 I8 N8 O24 - | 8 | 1 | NA1044 | Sabatino, P.; Recanatini, M.; Tumiatti, V.; Melchiorre, C. | Structural studies on the antimuscarinic agents spiro-DAMP and hydroxy-DAMP, and comparison with related compounds | Acta Crystallographica Section C | 1,994 | 50 | 4 | 640 | 645 | 10.1107/S0108270193010017 | 0.71069 | MoKα | null | 0.039 | null | null | 0.042 | null | null | null | null | 1.04 | 1.04 | null | null | null | has coordinates | Sabatino, P.; Recanatini, M.; Tumiatti, V.; Melchiorre, C.
Structural studies on the antimuscarinic agents spiro-DAMP and hydroxy-DAMP, and comparison with related compounds
Acta Crystallographica Section C
50(4)
(1994)
640-645 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,804 | 8.669 | 0.003 | 5.55 | 0.001 | 10.456 | 0.002 | 90 | null | 106.8 | 0.02 | 90 | null | 481.6 | 0.2 | 297 | null | 297 | null | null | null | null | null | synthesis | 4 | P 1 21/a 1 | -P 2yab | 14 | copper(I) cyanide/1,4-butanediamine complex | - C6 H12 Cu2 N4 - | - C6 H12 Cu2 N4 - | - C12 H24 Cu4 N8 - | 2 | 0.5 | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton | Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines | Inorganic Chemistry | 1,999 | 38 | 984 | 991 | 10.1021/ic970226b | 0.71073 | MoKalpha | null | 0.028 | null | null | 0.031 | null | null | null | null | 1.13 | 1.13 | null | null | null | has coordinates | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton
Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines
Inorganic Chemistry
38
(1999)
984-991 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,638 | 9.681 | 0.002 | 22.465 | 0.006 | 10.463 | 0.005 | 90 | null | 113.9 | 0.2 | 90 | null | 2,080 | 3 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | null | - C21 H26 I N O3 - | - C21 H26 I N O3 - | - C84 H104 I4 N4 O12 - | 4 | 1 | NA1044 | Sabatino, P.; Recanatini, M.; Tumiatti, V.; Melchiorre, C. | Structural studies on the antimuscarinic agents spiro-DAMP and hydroxy-DAMP, and comparison with related compounds | Acta Crystallographica Section C | 1,994 | 50 | 4 | 640 | 645 | 10.1107/S0108270193010017 | 0.71069 | MoKα | null | 0.043 | null | null | 0.046 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Sabatino, P.; Recanatini, M.; Tumiatti, V.; Melchiorre, C.
Structural studies on the antimuscarinic agents spiro-DAMP and hydroxy-DAMP, and comparison with related compounds
Acta Crystallographica Section C
50(4)
(1994)
640-645 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
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