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|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
2,009,471 | 8.68 | 0.005 | 28.35 | 0.02 | 9.022 | 0.004 | 90 | null | 99.81 | 0.04 | 90 | null | 2,188 | 2 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C21 H21 I O3 Sn - | - C21 H21 I O3 Sn - | - C84 H84 I4 O12 Sn4 - | 4 | 1 | MU1066 | Howie, R.A.; Ross, J.N.; Wardell, J.L.; Low, J.N. | Tris(2-methoxyphenyl)tin iodide | Acta Crystallographica Section C | 1,994 | 50 | 2 | 229 | 231 | 10.1107/S0108270193008297 | 0.71073 | MoKα | null | 0.064 | null | null | 0.058 | null | null | null | null | null | null | null | null | null | has coordinates | Howie, R.A.; Ross, J.N.; Wardell, J.L.; Low, J.N.
Tris(2-methoxyphenyl)tin iodide
Acta Crystallographica Section C
50(2)
(1994)
229-231 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
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4,321,835 | 12.516 | 0.002 | 21.327 | 0.003 | 22.764 | 0.003 | 90 | null | 98.281 | 0.013 | 90 | null | 6,013 | 1.5 | 130 | 2 | 130 | 2 | null | null | null | null | 6 | C 1 c 1 | C -2yc | 9 | - C57 H56 Cl11 N4 O4 Zn - | - C57 H48 Cl11 N4 O4 Zn - | - C228 H192 Cl44 N16 O16 Zn4 - | 4 | 1 | Noëlle Ehlinger; W. Robert Scheidt | Structure and Apparent Reactivity of the π-Cation Radical Derivatives of Zinc and Copper 5,10,15,20-Tetra(2,6-dichlorophenyl)porphyrinate | Inorganic Chemistry | 1,999 | 38 | 1316 | 1321 | 10.1021/ic981041n | 0.71073 | MoKα | 0.098 | 0.0742 | null | null | 0.1834 | 0.2033 | null | null | null | null | null | 1.053 | null | null | has coordinates | Noëlle Ehlinger; W. Robert Scheidt
Structure and Apparent Reactivity of the π-Cation Radical Derivatives of Zinc and Copper 5,10,15,20-Tetra(2,6-dichlorophenyl)porphyrinate
Inorganic Chemistry
38
(1999)
1316-1321 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,472 | 8.831 | 0.002 | 11.955 | 0.002 | 10.834 | 0.002 | 90 | null | 108.12 | 0.03 | 90 | null | 1,087.1 | 0.4 | 293 | 2 | 293 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | tetrakis(dimethyl sulfoxide)di-μ-fluoro-hexafluorodizirconium(IV) | - C8 H24 F8 O4 S4 Zr2 - | - C4 H12 F4 O2 S2 Zr - | - C16 H48 F16 O8 S8 Zr4 - | 4 | 1 | MU1073 | Alcock, Nathaniel W.; Errington, William; Golby, Sarah L.; Patterson, Siobhan M.C.; Wallbridge, Malcolm G.H. | Di-μ-fluoro-bis[bis(dimethyl sulfoxide)trifluorozirconium(IV)] | Acta Crystallographica Section C | 1,994 | 50 | 2 | 226 | 227 | 10.1107/S0108270193008054 | 0.71073 | MoKα | 0.0661 | 0.0527 | null | 0.1497 | 0.1497 | null | null | null | 1.07 | 1.068 | 1.068 | null | null | null | has coordinates | Alcock, Nathaniel W.; Errington, William; Golby, Sarah L.; Patterson, Siobhan M.C.; Wallbridge, Malcolm G.H.
Di-μ-fluoro-bis[bis(dimethyl sulfoxide)trifluorozirconium(IV)]
Acta Crystallographica Section C
50(2)
(1994)
226-227 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,473 | 21.9907 | 0.0011 | 15.3069 | 0.001 | 17.0651 | 0.0008 | 90 | null | 119.039 | 0.004 | 90 | null | 5,022.2 | 0.5 | 293 | null | 293 | null | null | null | null | null | 5 | C 1 2/c 1 | -C 2yc | 15 | (ferrocenylmethyl)triphenylphosphonium iodide | (ferrocenylmethyl)triphenylphosphonium iodide | - C29 H26 Fe I P - | - C29 H26 Fe I P - | - C232 H208 Fe8 I8 P8 - | 8 | 1 | MU1077 | Glidewell, Christopher; Zakaria, Choudhury M.; Ferguson, George; Gallagher, John F. | C‒H^{···^}I^{-^} interactions in ferrocene derivatives: structures of (Ferrocenylmethyl)triphenylphosphonium iodide and 1,1'-ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1) | Acta Crystallographica Section C | 1,994 | 50 | 2 | 233 | 238 | 10.1107/S0108270193007929 | 0.71073 | MolybdenumKα | 0.041 | 0.023 | null | 0.036 | 0.034 | null | null | null | null | 1.41 | 1.41 | null | null | null | has coordinates | Glidewell, Christopher; Zakaria, Choudhury M.; Ferguson, George; Gallagher, John F.
C‒H^{···^}I^{-^} interactions in ferrocene derivatives: structures of (Ferrocenylmethyl)triphenylphosphonium iodide and 1,1'-ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1)
Acta Crystallographica Sectio... | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,474 | 10.2799 | 0.0008 | 13.0137 | 0.0007 | 19.3758 | 0.0011 | 105.137 | 0.005 | 98.049 | 0.006 | 107.414 | 0.006 | 2,319.5 | 0.3 | 293 | null | 293 | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | 1,1'-Ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1) | 1,1'-Ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1) | - C49 H44 Cl2 Fe I2 P2 - | - C49 H43.5 Cl2 Fe I2 P2 - | - C98 H87 Cl4 Fe2 I4 P4 - | 2 | 1 | MU1077 | Glidewell, Christopher; Zakaria, Choudhury M.; Ferguson, George; Gallagher, John F. | C‒H^{···^}I^{-^} interactions in ferrocene derivatives: structures of (Ferrocenylmethyl)triphenylphosphonium iodide and 1,1'-ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1) | Acta Crystallographica Section C | 1,994 | 50 | 2 | 233 | 238 | 10.1107/S0108270193007929 | 0.71073 | MolybdenumKα | 0.067 | 0.032 | null | 0.046 | 0.041 | null | null | null | null | 1.31 | 1.31 | null | null | null | has coordinates | Glidewell, Christopher; Zakaria, Choudhury M.; Ferguson, George; Gallagher, John F.
C‒H^{···^}I^{-^} interactions in ferrocene derivatives: structures of (Ferrocenylmethyl)triphenylphosphonium iodide and 1,1'-ferrocenediylbis(methyltriphenylphosphonium iodide) dichloromethane solvate (1/1)
Acta Crystallographica Sectio... | 191,977 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,475 | 41.505 | 0.006 | 19.45 | 0.002 | 6.338 | 0.001 | 90 | null | 90 | null | 90 | null | 5,116.5 | 1.2 | 293 | null | null | null | null | null | null | null | 4 | F d d 2 | F 2 -2d | null | - C13 H16 N2 O3 - | - C13 H16 N2 O3 - | - C208 H256 N32 O48 - | 16 | 1 | NA1033 | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C. | Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives | Acta Crystallographica Section C | 1,994 | 50 | 2 | 239 | 245 | 10.1107/S0108270193006997 | 0.71069 | MoKα | null | 0.029 | null | null | 0.032 | null | null | null | null | 1.139 | 1.139 | null | null | null | has coordinates | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C.
Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives
Acta Crystallographica Section C
50(2)
(1994)
239-245 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,834 | 16.766 | 0.004 | 9.287 | 0.002 | 7.392 | 0.002 | 90 | null | 110.536 | 0.006 | 90 | null | 1,077.8 | 0.5 | 120 | 2 | 120 | 2 | null | null | null | null | Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl | 5 | C 1 2/c 1 | -C 2yc | 15 | - C5 H4 Br Cu0.5 N - | - C5 H4 Br Cu0.5 N - | - C40 H32 Br8 Cu4 N8 - | 8 | 1 | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta | Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6] | Inorganic Chemistry | 1,999 | 38 | 1288 | 1292 | 10.1021/ic980997v | 0.71073 | MoKα | 0.0423 | 0.0351 | null | 0.089 | 0.0861 | null | null | null | 1.035 | 1.074 | 1.074 | null | null | null | has coordinates | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta
Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]
Inorganic Chemistr... | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,476 | 36.05 | 0.005 | 4.943 | 0.001 | 19.793 | 0.003 | 90 | null | 108.72 | 0.01 | 90 | null | 3,340.4 | 1 | 293 | null | null | null | null | null | null | null | 4 | C 1 c 1 | C -2yc | null | - C17 H18 N4 O3 - | - C8.5 H9 N2 O1.5 - | - C68 H72 N16 O12 - | 8 | 2 | NA1033 | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C. | Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives | Acta Crystallographica Section C | 1,994 | 50 | 2 | 239 | 245 | 10.1107/S0108270193006997 | 0.71069 | MoKα | null | 0.038 | null | null | 0.048 | null | null | null | null | 1.13 | 1.13 | null | null | null | has coordinates | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C.
Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives
Acta Crystallographica Section C
50(2)
(1994)
239-245 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,477 | 9.398 | 0.001 | 18.422 | 0.002 | 12.663 | 0.001 | 90 | null | 91.46 | 0.01 | 90 | null | 2,191.6 | 0.4 | 293 | null | null | null | null | null | null | null | 4 | P 1 21 1 | P 2yb | 4 | - C21 H23 N5 O5 - | - C21 H25 N5 O5 - | - C84 H100 N20 O20 - | 4 | 2 | NA1033 | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C. | Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives | Acta Crystallographica Section C | 1,994 | 50 | 2 | 239 | 245 | 10.1107/S0108270193006997 | 0.71069 | MoKα | null | 0.034 | null | null | 0.041 | null | null | null | null | 0.7469 | 0.7469 | null | null | null | has coordinates | Djinović-Carugo, K.; Golič, L.; Leban, I.; Svete, J.; Stanovnik, B.; Tišler, M.; Tate, C.
Three substituted 3-amino-2-benzoylaminopropenoic acid derivatives
Acta Crystallographica Section C
50(2)
(1994)
239-245 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,478 | 23.92 | 0.008 | 5.593 | 0.002 | 16.028 | 0.009 | 90 | null | 100.74 | 0.04 | 90 | null | 2,106.7 | 1.6 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C23 H25 N O5 - | - C23 H25 N O5 - | - C92 H100 N4 O20 - | 4 | 1 | NA1045 | Centore, R. | 2-(4-Pentanoyloxyphenyl)-6-pentanoyloxybenzoxazole | Acta Crystallographica Section C | 1,994 | 50 | 2 | 260 | 263 | 10.1107/S010827019300678X | 0.71069 | MoKα(graphitemonochromated) | null | 0.053 | null | null | 0.055 | null | null | null | null | 1.555 | 1.555 | null | null | null | has coordinates | Centore, R.
2-(4-Pentanoyloxyphenyl)-6-pentanoyloxybenzoxazole
Acta Crystallographica Section C
50(2)
(1994)
260-263 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,479 | 11.679 | 0.002 | 8.301 | 0.001 | 13.554 | 0.001 | 90 | null | 91.97 | 0.02 | 90 | null | 1,313.2 | 0.3 | 292 | null | 292 | null | null | null | null | null | 5 | P 1 21/a 1 | -P 2yab | 14 | 2-{[5-Phenyl-1,3,4(3H)-thiadiazin-2-yl]imino}-3-pyridinol | - C14 H12 N4 O S - | - C14 H12 N4 O S - | - C56 H48 N16 O4 S4 - | 4 | 1 | NA1048 | Josef Macíček; Olyana Angelova; Veneta Kalcheva; Madlena Tosheva | 2-[(5-Phenyl-2,3-dihydro-6<i>H</i>-1,3,4-thiadiazin-2-ylidene)amino]-3-pyridinol | Acta Crystallographica Section C | 1,994 | 50 | 2 | 252 | 254 | 10.1107/S0108270193011916 | 0.71073 | MoKα | 0.114 | 0.034 | null | 0.059 | 0.03 | null | null | null | 2.171 | 1.48 | 1.48 | null | null | null | has coordinates | Josef Macíček; Olyana Angelova; Veneta Kalcheva; Madlena Tosheva
2-[(5-Phenyl-2,3-dihydro-6<i>H</i>-1,3,4-thiadiazin-2-ylidene)amino]-3-pyridinol
Acta Crystallographica Section C
50(2)
(1994)
252-254 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,480 | 16.768 | 0.006 | 8.958 | 0.003 | 17.243 | 0.004 | 90 | null | 113.5 | 0.02 | 90 | null | 2,375.2 | 1.3 | 295 | 2 | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | - C26 H31 N3 O4 - | - C26 H31 N3 O4 - | - C104 H124 N12 O16 - | 4 | 1 | OH1017 | Kido, M.; Kondo, K.; Yamashita, H.; Ogawa, H. | Structure of OPC-21268 | Acta Crystallographica Section C | 1,994 | 50 | 2 | 302 | 304 | 10.1107/S0108270193007358 | 0.7107 | MoKα | null | 0.043 | null | null | 0.049 | null | null | null | null | 1.39 | 1.39 | null | null | null | has coordinates | Kido, M.; Kondo, K.; Yamashita, H.; Ogawa, H.
Structure of OPC-21268
Acta Crystallographica Section C
50(2)
(1994)
302-304 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,481 | 7.404 | 0.001 | 5.591 | 0.001 | 87.662 | 0.009 | 90 | null | 90 | null | 90 | null | 3,628.8 | 0.9 | 296 | null | null | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | null | - C18 H36 O2 - | - C18 H36 O2 - | - C144 H288 O16 - | 8 | 1 | OH1030 | Kaneko, F.; Sakashita, H.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Suzuki, M. | Double-layered polytypic structure of the B form of octadecanoic acid, C~18~H~36~O~2~ | Acta Crystallographica Section C | 1,994 | 50 | 2 | 245 | 247 | 10.1107/S010827019300736X | 1.5418 | CuKα | null | 0.062 | null | null | 0.086 | null | null | null | null | 1.66 | 1.66 | null | null | null | has coordinates | Kaneko, F.; Sakashita, H.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Suzuki, M.
Double-layered polytypic structure of the B form of octadecanoic acid, C~18~H~36~O~2~
Acta Crystallographica Section C
50(2)
(1994)
245-247 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,833 | 10.604 | 0.002 | 11.642 | 0.003 | 11.688 | 0.003 | 61.965 | 0.005 | 68.346 | 0.005 | 69.523 | 0.005 | 1,156 | 0.5 | 120 | 2 | 120 | 2 | null | null | null | null | Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl | 5 | P -1 | -P 1 | 2 | - C20 H16 Br4 Cu3 N4 - | - C20 H16 Br4 Cu3 N4 - | - C40 H32 Br8 Cu6 N8 - | 2 | 1 | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta | Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6] | Inorganic Chemistry | 1,999 | 38 | 1288 | 1292 | 10.1021/ic980997v | 0.71073 | MoKα | 0.0582 | 0.0408 | null | 0.0947 | 0.0877 | null | null | null | 1.051 | 1.092 | 1.092 | null | null | null | has coordinates | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta
Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]
Inorganic Chemistr... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,482 | 23.386 | 0.005 | 9.69 | 0.002 | 20.367 | 0.005 | 90 | null | 114.94 | 0.02 | 90 | null | 4,185 | 1.8 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C44 H61 B F4 N4 - | - C44 H61 B F4 N4 - | - C176 H244 B4 F16 N16 - | 4 | 1 | OH1033 | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T. | HBF~4~ and HBr salts of new chiral cyclens | Acta Crystallographica Section C | 1,994 | 50 | 2 | 306 | 312 | 10.1107/S0108270193007139 | 0.71073 | MoKα | null | 0.06 | null | null | 0.055 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T.
HBF~4~ and HBr salts of new chiral cyclens
Acta Crystallographica Section C
50(2)
(1994)
306-312 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,483 | 20.81 | 0.01 | 15.03 | 0.01 | 13.88 | 0.01 | 90 | null | 90 | null | 90 | null | 4,341 | 5 | 296 | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C32 H62 B2 F8 N4 O8 - | - C32 H62 B2 F8 N4 O8 - | - C128 H248 B8 F32 N16 O32 - | 4 | 1 | OH1033 | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T. | HBF~4~ and HBr salts of new chiral cyclens | Acta Crystallographica Section C | 1,994 | 50 | 2 | 306 | 312 | 10.1107/S0108270193007139 | 0.71073 | MoKα | null | 0.108 | null | null | 0.096 | null | null | null | null | 3.04 | 3.04 | null | null | null | has coordinates | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T.
HBF~4~ and HBr salts of new chiral cyclens
Acta Crystallographica Section C
50(2)
(1994)
306-312 | 190,732 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,484 | 9.973 | 0.001 | 20.718 | 0.003 | 7.541 | 0.002 | 90 | null | 90 | null | 90 | null | 1,558.1 | 0.5 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 2 | P 2 2ab | null | - C30 H50 Br2 N4 - | - C30 H50 Br2 N4 - | - C60 H100 Br4 N8 - | 2 | 0.5 | OH1033 | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T. | HBF~4~ and HBr salts of new chiral cyclens | Acta Crystallographica Section C | 1,994 | 50 | 2 | 306 | 312 | 10.1107/S0108270193007139 | 0.71073 | MoKα | null | 0.06 | null | null | 0.068 | null | null | null | null | 2.18 | 2.18 | null | null | null | has coordinates | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T.
HBF~4~ and HBr salts of new chiral cyclens
Acta Crystallographica Section C
50(2)
(1994)
306-312 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,485 | 17.243 | 0.003 | 17.873 | 0.002 | 14.156 | 0.002 | 90 | null | 90 | null | 90 | null | 4,362.7 | 1.1 | 293 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C44 H62 Br2 N4 - | - C44 H62 Br2 N4 - | - C176 H248 Br8 N16 - | 4 | 1 | OH1033 | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T. | HBF~4~ and HBr salts of new chiral cyclens | Acta Crystallographica Section C | 1,994 | 50 | 2 | 306 | 312 | 10.1107/S0108270193007139 | 0.71073 | MoKα | null | 0.099 | null | null | 0.112 | null | null | null | null | 5.83 | 5.83 | null | null | null | has coordinates | Kobayashi, K.; Tsuboyama, S.; Tsuboyama, K.; Sakurai, T.
HBF~4~ and HBr salts of new chiral cyclens
Acta Crystallographica Section C
50(2)
(1994)
306-312 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,486 | 11.096 | 0.002 | 17.308 | 0.003 | 10.526 | 0.002 | 90 | null | 116.53 | 0.01 | 90 | null | 1,808.6 | 0.6 | 296 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C12 H40 Mo8 N4 O26 - | - C12 H40 Mo8 N4 O26 - | - C24 H80 Mo16 N8 O52 - | 2 | 0.5 | OH1037 | Gutiérrez-Zorrilla, J.M.; Yamase, T.; Sugeta, M. | Tetrakis(isopropylammonium) β-octamolybdate(VI) | Acta Crystallographica Section C | 1,994 | 50 | 2 | 196 | 198 | 10.1107/S0108270193007371 | 0.71069 | MoKα | null | 0.0294 | null | null | 0.0329 | null | null | null | null | 4.82 | 4.82 | null | null | null | has coordinates | Gutiérrez-Zorrilla, J.M.; Yamase, T.; Sugeta, M.
Tetrakis(isopropylammonium) β-octamolybdate(VI)
Acta Crystallographica Section C
50(2)
(1994)
196-198 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,487 | 7.359 | 0.001 | 5.609 | 0.001 | 88.41 | 0.01 | 90 | null | 90 | null | 90 | null | 3,649.3 | 0.9 | 286 | null | null | null | null | null | null | null | 3 | P b c a | -P 2ac 2ab | null | - C18 H36 O2 - | - C18 H36 O2 - | - C144 H288 O16 - | 8 | 1 | OH1038 | Kaneko, F.; Sakashita, H.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Suzuki, M. | Double-layered polytypic structure of the E form of octadecanoic acid, C~18~H~36~O~2~ | Acta Crystallographica Section C | 1,994 | 50 | 2 | 247 | 250 | 10.1107/S0108270193007243 | 1.5418 | CuKα | null | 0.064 | null | null | 0.095 | null | null | null | null | 1.99 | 1.99 | null | null | null | has coordinates | Kaneko, F.; Sakashita, H.; Kobayashi, M.; Kitagawa, Y.; Matsuura, Y.; Suzuki, M.
Double-layered polytypic structure of the E form of octadecanoic acid, C~18~H~36~O~2~
Acta Crystallographica Section C
50(2)
(1994)
247-250 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,488 | 5.7238 | 0.0007 | 5.7238 | 0.0007 | 13.9649 | 0.0007 | 90 | null | 90 | null | 120 | null | 396.22 | 0.07 | 296 | null | 296 | null | null | null | null | null | 3 | P 63/m m c | -P 6c 2c | 194 | - Ba O3 Ti - | - Ba O3 Ti - | - Ba6 O18 Ti6 - | 6 | 0.25 | OH1053 | Akimoto, J.; Gotoh, Y.; Oosawa, Y. | Refinement of hexagonal BaTiO~3~ | Acta Crystallographica Section C | 1,994 | 50 | 2 | 160 | 161 | 10.1107/S0108270193008637 | 0.71069 | MoKα | 0.043 | 0.037 | null | 0.036 | 0.036 | null | null | null | null | null | null | null | null | null | has coordinates | Akimoto, J.; Gotoh, Y.; Oosawa, Y.
Refinement of hexagonal BaTiO~3~
Acta Crystallographica Section C
50(2)
(1994)
160-161 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,489 | 9.111 | 0.004 | 6.547 | 0.004 | 17.93 | 0.01 | 90 | null | 98.8 | 0.05 | 90 | null | 1,056.9 | 1 | 293 | 1 | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C9 H10 N2 O4 S - | - C9 H10 N2 O4 S - | - C36 H40 N8 O16 S4 - | 4 | 1 | PA1040 | Viossat, B.; Nguyen-Huy, D.; Tomas, A.; Esanu, A.; Rolland, A. | Structure du 5-méthyl-2-thioxo-1,2,3,4-tétrahydro-7<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidine-4,7-dione méthanol solvaté, C~8~H~6~N~2~O~3~S.CH~4~O | Acta Crystallographica Section C | 1,994 | 50 | 2 | 269 | 271 | 10.1107/S0108270193003592 | 0.7107 | MoKα | null | 0.056 | null | null | 0.042 | null | null | null | null | 2.02 | 2.02 | null | null | null | has coordinates | Viossat, B.; Nguyen-Huy, D.; Tomas, A.; Esanu, A.; Rolland, A.
Structure du 5-méthyl-2-thioxo-1,2,3,4-tétrahydro-7<i>H</i>-pyrano[2,3-<i>d</i>]pyrimidine-4,7-dione méthanol solvaté, C~8~H~6~N~2~O~3~S.CH~4~O
Acta Crystallographica Section C
50(2)
(1994)
269-271 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,832 | 10.907 | 0.003 | 6.0677 | 0.0013 | 21.62 | 0.005 | 90 | null | 90.542 | 0.004 | 90 | null | 1,430.8 | 0.6 | 120 | 2 | 293 | 2 | null | null | null | null | Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl | 6 | P 1 21/n 1 | -P 2yn | 14 | - C10 H9 Br3 Cu3 N2 O - | - C10 H9 Br3 Cu3 N2 O - | - C40 H36 Br12 Cu12 N8 O4 - | 4 | 1 | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta | Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6] | Inorganic Chemistry | 1,999 | 38 | 1288 | 1292 | 10.1021/ic980997v | 0.71073 | MoKα | 0.0622 | 0.037 | null | 0.0786 | 0.0718 | null | null | null | 0.986 | 1.064 | 1.064 | null | null | null | has coordinates | Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta
Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]
Inorganic Chemistr... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,490 | 9.62 | 0.003 | 11.051 | 0.002 | 13.017 | 0.003 | 113.1 | 0.04 | 96.8 | 0.03 | 90.26 | 0.02 | 1,262 | 0.7 | 293 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C40 H32 Mo6 O19 S8 - | - C40 H32 Mo6 O19 S8 - | - C40 H32 Mo6 O19 S8 - | 1 | 0.5 | PA1043 | Triki, S.; Ouahab, L.; Fabre, J.M. | 3,3'-Dimethyl-4,4'-diphenyl-2,2',5,5'-tetrathiafulvalenium hexamolybdate, 2(C~20~H~16~S~4~^+^)[Mo~6~O~19~]^2{-^} | Acta Crystallographica Section C | 1,994 | 50 | 2 | 219 | 221 | 10.1107/S0108270193007292 | 0.71073 | MoKα | null | 0.028 | null | null | 0.037 | null | null | null | null | 0.855 | 0.855 | null | null | null | has coordinates | Triki, S.; Ouahab, L.; Fabre, J.M.
3,3'-Dimethyl-4,4'-diphenyl-2,2',5,5'-tetrathiafulvalenium hexamolybdate, 2(C~20~H~16~S~4~^+^)[Mo~6~O~19~]^2{-^}
Acta Crystallographica Section C
50(2)
(1994)
219-221 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,491 | 14.81 | 0.005 | 15.61 | 0.004 | 19.757 | 0.006 | 90 | null | 90 | null | 90 | null | 4,568 | 2 | 293 | null | null | null | null | null | null | null | 5 | P c a b | -P 2bc 2ac | 61 | - C26 H19 Cl2 Co N3 - | - C26 H19 Cl2 Co N3 - | - C208 H152 Cl16 Co8 N24 - | 8 | 1 | PA1052 | Viossat, B.; Nguyen-Huy, Dung; Lehuede, J.; Vierfond, J.M. | Dichloro(2,5-diphényl-3,4-di-2-pyridyl-1<i>H</i>-pyrrole-<i>N</i>,<i>N</i>')cobalt(II) | Acta Crystallographica Section C | 1,994 | 50 | 2 | 211 | 214 | 10.1107/S0108270193007309 | 0.7107 | MoKα | null | 0.048 | null | null | 0.052 | null | null | null | null | 1.1 | 1.1 | null | null | null | has coordinates | Viossat, B.; Nguyen-Huy, Dung; Lehuede, J.; Vierfond, J.M.
Dichloro(2,5-diphényl-3,4-di-2-pyridyl-1<i>H</i>-pyrrole-<i>N</i>,<i>N</i>')cobalt(II)
Acta Crystallographica Section C
50(2)
(1994)
211-214 | 205,962 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-01-31 14:43:35 +0200 (Wed, 31 Jan 2018) $
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2,009,492 | 12.188 | 0.002 | 16.518 | 0.003 | 5.908 | 0.001 | 90 | null | 102.57 | 0.01 | 90 | null | 1,160.9 | 0.3 | 293 | null | 293 | null | null | null | null | null | 6 | I 1 m 1 | I -2y | 8 | Disodium Bis(chloranilato)uranyl(VI) Hexahydrate | - C12 H12 Cl4 Na2 O16 U - | - C12 H12 Cl4 Na2 O16 U - | - C24 H24 Cl8 Na4 O32 U2 - | 2 | 0.5 | SE1025 | Bram, Andreas; Bruederl, Georg; Burzlaff, Hans; Lange, Joachim; Rothammel, Walter; Spengler, Roland; Karayannis, M.I.; Veltsistas, P.G. | Disodium bis(<i>o</i>-chloranilato)uranyl(VI) hexahydrate | Acta Crystallographica Section C | 1,994 | 50 | 2 | 178 | 180 | 10.1107/S0108270193011680 | 0.7093 | MoKα~1~ | null | 0.016 | null | null | 0.019 | null | null | null | null | 1.76 | 1.76 | null | null | null | has coordinates | Bram, Andreas; Bruederl, Georg; Burzlaff, Hans; Lange, Joachim; Rothammel, Walter; Spengler, Roland; Karayannis, M.I.; Veltsistas, P.G.
Disodium bis(<i>o</i>-chloranilato)uranyl(VI) hexahydrate
Acta Crystallographica Section C
50(2)
(1994)
178-180 | 176,432 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,493 | 8.116 | 0.002 | 11.246 | 0.003 | 17.243 | 0.003 | 90 | null | 101.49 | 0.01 | 90 | null | 1,542.3 | 0.6 | 293 | null | 293 | null | null | null | null | null | 5 | P 1 2/n 1 | -P 2yac | 13 | Tetra(N-methylimidazol)-kupfer(II)-bis(triiodid) | - C16 H24 Cu I6 N8 - | - C16 H24 Cu I6 N8 - | - C32 H48 Cu2 I12 N16 - | 2 | 0.5 | SE1026 | Tebbe, Karl-Friedrich; Nafepour, Shida | Tetra(<i>N</i>-methylimidazol)-kupfer(II)-bis(triiodid) [Cu(C~4~H~6~N~2~)~4~](I~3~)~2~ | Acta Crystallographica Section C | 1,994 | 50 | 2 | 171 | 173 | 10.1107/S0108270193007140 | 0.71069 | MoKα | 0.0394 | 0.0296 | null | 0.0335 | 0.0292 | null | null | null | 3.048 | 3.171 | 3.171 | null | null | null | has coordinates | Tebbe, Karl-Friedrich; Nafepour, Shida
Tetra(<i>N</i>-methylimidazol)-kupfer(II)-bis(triiodid) [Cu(C~4~H~6~N~2~)~4~](I~3~)~2~
Acta Crystallographica Section C
50(2)
(1994)
171-173 | 191,032 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,494 | 8.848 | 0.003 | 16.139 | 0.003 | 16.465 | 0.004 | 90 | null | 103.64 | 0.02 | 90 | null | 2,284.9 | 1.1 | 291 | 1 | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C22 H19 N3 S3 Sn - | - C22 H19 N3 S3 Sn - | - C88 H76 N12 S12 Sn4 - | 4 | 1 | SH1055 | Schürmann, M.; Huber, F. | Tris(2-pyridinethiolato)(<i>p</i>-tolyl)tin(IV), [Sn(C~5~H~4~NS)~3~(C~7~H~7~)] | Acta Crystallographica Section C | 1,994 | 50 | 2 | 206 | 209 | 10.1107/S0108270193007310 | 0.71073 | MoKα | null | 0.0485 | null | null | 0.0393 | null | null | null | null | 0.6 | 0.6 | null | null | null | has coordinates | Schürmann, M.; Huber, F.
Tris(2-pyridinethiolato)(<i>p</i>-tolyl)tin(IV), [Sn(C~5~H~4~NS)~3~(C~7~H~7~)]
Acta Crystallographica Section C
50(2)
(1994)
206-209 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
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2,009,495 | 10.342 | 0.002 | 24.358 | 0.002 | 25.962 | 0.005 | 90 | null | 96.358 | 0.009 | 90 | null | 6,499.9 | 1.9 | 295 | null | null | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | null | - C76 H72 B O2 P4 Tc - | - C76 H68 B O2 P4 Tc - | - C304 H272 B4 O8 P16 Tc4 - | 4 | 1 | SH1056 | Hübener, R.; Abram, U.; Hiller, W. | <i>trans</i>-Bisaquabis[1,2-bis(diphenylphosphino)ethane]technetium(I) tetraphenylborate | Acta Crystallographica Section C | 1,994 | 50 | 2 | 188 | 190 | 10.1107/S0108270193006791 | 1.54056 | CuKα | null | 0.068 | null | null | 0.073 | null | null | null | null | 3.943 | 3.943 | null | null | null | has coordinates | Hübener, R.; Abram, U.; Hiller, W.
<i>trans</i>-Bisaquabis[1,2-bis(diphenylphosphino)ethane]technetium(I) tetraphenylborate
Acta Crystallographica Section C
50(2)
(1994)
188-190 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,831 | 30.4228 | 0.0007 | 18.372 | 0.0005 | 32.3758 | 0.0008 | 90 | null | 95.857 | 0.001 | 90 | null | 18,001.3 | 0.8 | 198 | 2 | 198 | 2 | null | null | null | null | 6 | P 1 21/n 1 | -P 2yn | 14 | - C56 H162 As24 Cl6 S52 Zn16 - | - C56 H162 As24 Cl6 S52 Zn16 - | - C224 H648 As96 Cl24 S208 Zn64 - | 4 | 1 | Alberto Albinati; Maurizio Casarin; Chiara Maccato; Luciano Pandolfo; Andrea Vittadini | Experimental and Theoretical Investigation of the Molecular and Electronic Structure of [Zn4(μ4-S){μ-S2As(CH3)2}6] and [Cd4(μ4-S){μ-S2As(CH3)2}6]: Two Possible Molecular Models of Extended Metal Chalcogenide Semiconductors | Inorganic Chemistry | 1,999 | 38 | 1145 | 1152 | 10.1021/ic980914a | 0.71073 | MoKα | 0.0702 | 0.0424 | null | null | 0.1074 | 0.1305 | null | null | null | null | null | 0.866 | null | null | has coordinates | Alberto Albinati; Maurizio Casarin; Chiara Maccato; Luciano Pandolfo; Andrea Vittadini
Experimental and Theoretical Investigation of the Molecular and Electronic Structure of [Zn4(μ4-S){μ-S2As(CH3)2}6] and [Cd4(μ4-S){μ-S2As(CH3)2}6]: Two Possible Molecular Models of Extended Metal Chalcogenide Semiconductors
Inorganic ... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,496 | 17.723 | 0.003 | 15.126 | 0.003 | 14.796 | 0.003 | 90 | null | 90 | null | 90 | null | 3,966.5 | 1.3 | 221 | 3 | 221 | 3 | null | null | null | null | 5 | P b c n | -P 2n 2ab | 60 | 2,2'-bipyridyl meso-oxolane-3,4-diolato(2-) palladium(II) 6.5-hydrate | - C14 H27 N2 O9.5 Pd - | - C14 H27 N2 O9.5 Pd - | - C112 H216 N16 O76 Pd8 - | 8 | 1 | SH1065 | Achternbosch, Matthias; Klüfers, Peter | Polyol metal complexes. V. Structure of (2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')[<i>meso</i>-oxolane-3,4-diolato(2–)-κ^2^<i>O</i>,<i>O</i>']palladium(II) 6.5-hydrate | Acta Crystallographica Section C | 1,994 | 50 | 2 | 175 | 178 | 10.1107/S0108270193007322 | 0.71069 | MoKα | 0.0539 | 0.0266 | null | 0.0704 | 0.0618 | null | null | null | 1.046 | 1.106 | 1.106 | null | null | null | has coordinates | Achternbosch, Matthias; Klüfers, Peter
Polyol metal complexes. V. Structure of (2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')[<i>meso</i>-oxolane-3,4-diolato(2–)-κ^2^<i>O</i>,<i>O</i>']palladium(II) 6.5-hydrate
Acta Crystallographica Section C
50(2)
(1994)
175-178 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,497 | 10.904 | 0.001 | 10.3686 | 0.0008 | 13.887 | 0.002 | 90 | null | 102.132 | 0.007 | 90 | null | 1,535 | 0.3 | 251 | null | 251 | null | null | null | null | null | 3 | P 1 21/a 1 | -P 2yab | 14 | 1-(1,2,6,7,8,8a-hexahydro-3,6,6,8a-tetramethylacenaphthylen-4-yl)ethan-1-one | - C18 H24 O - | - C18 H24 O - | - C72 H96 O4 - | 4 | 1 | SH1068 | De Ridder, Dirk J.A.; Goubitz, Kees; Schenk, Henk | Crystal studies of musk compounds. V. Structure of 1-(1,2,6,7,8,8a-hexahydro-3,6,6,8a-tetramethylacenaphthylen-4-yl)ethan-1-one | Acta Crystallographica Section C | 1,994 | 50 | 2 | 265 | 267 | 10.1107/S0108270193006821 | 1.5418 | CuKα | 0.057 | 0.057 | null | 0.067 | 0.067 | null | null | null | 0.14 | 0.14 | 0.14 | null | null | null | has coordinates | De Ridder, Dirk J.A.; Goubitz, Kees; Schenk, Henk
Crystal studies of musk compounds. V. Structure of 1-(1,2,6,7,8,8a-hexahydro-3,6,6,8a-tetramethylacenaphthylen-4-yl)ethan-1-one
Acta Crystallographica Section C
50(2)
(1994)
265-267 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,498 | 7.737 | 0.002 | 18.634 | 0.002 | 5.911 | 0.002 | 90 | null | 97.67 | 0.02 | 90 | null | 844.6 | 0.4 | 296 | null | null | null | null | null | null | null | 4 | C 1 2/m 1 | -C 2y | 12 | - C14 H14 Ca2 O13 - | - C14 H16 Ca2 O14 - | - C28 H32 Ca4 O28 - | 2 | 0.25 | ST1060 | Fitzgerald, L.J.; Gerkin, R.E. | Dicalcium 1,4,5,8-naphthalenetetracarboxylate pentahydrate | Acta Crystallographica Section C | 1,994 | 50 | 2 | 185 | 188 | 10.1107/S0108270193006092 | 0.71073 | MoKᾱ | null | 0.024 | null | null | 0.033 | null | null | null | null | 1.502 | 1.502 | null | null | null | has coordinates | Fitzgerald, L.J.; Gerkin, R.E.
Dicalcium 1,4,5,8-naphthalenetetracarboxylate pentahydrate
Acta Crystallographica Section C
50(2)
(1994)
185-188 | 277,834 | 2022-09-14 | 16:39:43 | #------------------------------------------------------------------------------
#$Date: 2022-09-14 19:38:48 +0300 (Wed, 14 Sep 2022) $
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2,009,499 | 13.325 | 0.002 | 17.26 | 0.002 | 7.114 | 0.001 | 90 | null | 90 | null | 90 | null | 1,636.1 | 0.4 | 120 | 1 | 120 | 1 | null | null | null | null | 4 | P n m a | -P 2ac 2n | 62 | Ethylene-1,2-bis(η^5^-2-indenyl)titanium (IV) dichloride | - C20 H16 Cl2 Ti - | - C20 H16 Cl2 Ti - | - C80 H64 Cl8 Ti4 - | 4 | 0.5 | ST1073 | Parkin, Sean; Hitchcock, Shawn R.; Hope, Hakon; Nantz, Michael H. | 2,2'-Ethylenebis(η^5^-indenyl)TiCl~2~ | Acta Crystallographica Section C | 1,994 | 50 | 2 | 169 | 171 | 10.1107/S0108270193007851 | 1.54178 | CuKα | 0.0436 | 0.0415 | null | 0.0946 | 0.0939 | null | null | null | 1.191 | 1.198 | 1.198 | null | null | null | has coordinates,has disorder | Parkin, Sean; Hitchcock, Shawn R.; Hope, Hakon; Nantz, Michael H.
2,2'-Ethylenebis(η^5^-indenyl)TiCl~2~
Acta Crystallographica Section C
50(2)
(1994)
169-171 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,500 | 4.9983 | 0.0007 | 4.9983 | 0.0007 | 25.502 | 0.005 | 90 | null | 90 | null | 90 | null | 637.12 | 0.18 | 295 | null | null | null | null | null | null | null | 3 | I 4/m m m | -I 4 2 | null | - Ba3 S7 Zr2 - | - Ba3 S7 Zr2 - | - Ba6 S14 Zr4 - | 2 | 0.0625 | ST1076 | Chen, Bai-Hao; Eichhorn, Bryan; Wong-Ng, Winnie | Structural reinvestigation of Ba~3~Zr~2~S~7~ by single-crystal X-ray diffraction | Acta Crystallographica Section C | 1,994 | 50 | 2 | 161 | 164 | 10.1107/S0108270193008972 | 0.71073 | MoKα | null | 0.054 | null | null | 0.063 | null | null | null | null | 1.83 | 1.83 | null | null | null | has coordinates | Chen, Bai-Hao; Eichhorn, Bryan; Wong-Ng, Winnie
Structural reinvestigation of Ba~3~Zr~2~S~7~ by single-crystal X-ray diffraction
Acta Crystallographica Section C
50(2)
(1994)
161-164 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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4,321,830 | 17.824 | 0.005 | 17.824 | 0.005 | 8.558 | 0.003 | 90 | null | 90 | null | 90 | null | 2,718.8 | 1.4 | 296.2 | null | 296.2 | null | null | null | null | null | 5 | P -4 21 c | P -4 2n | 114 | - C10 H15 Ag S3 W - | - C10 H15 Ag S3 W - | - C80 H120 Ag8 S24 W8 - | 8 | 1 | Jian-Ping Lang; Kazuyuki Tatsumi | Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4 | Inorganic Chemistry | 1,999 | 38 | 1364 | 1367 | 10.1021/ic980883j | 0.7107 | MoKα | 0 | 0 | null | null | 0 | 0.0732 | null | null | null | null | null | 2.45 | null | null | has coordinates | Jian-Ping Lang; Kazuyuki Tatsumi
Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4
Inorganic Chemistry
38
(1999)
1364-1367 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,501 | 9.306 | 0.002 | 9.184 | 0.002 | 18.506 | 0.004 | 90 | 0.02 | 103.19 | 0.02 | 90 | 0.02 | 1,539.9 | 0.6 | 294 | null | null | null | null | null | null | null | 2 | C 1 2/c 1 | -C 2yc | 15 | - C20 H30 - | - C20 H30 - | - C80 H120 - | 4 | 0.5 | ST1078 | Mielke, Karsten; Fry, James L.; Finnen, Daniel C.; Pinkerton, A. Alan | 2,2'-Biadamantane | Acta Crystallographica Section C | 1,994 | 50 | 2 | 267 | 269 | 10.1107/S0108270193008170 | 0.71073 | MoKα | null | 0.037 | null | null | 0.05 | null | null | null | null | 1.514 | 1.514 | null | null | null | has coordinates | Mielke, Karsten; Fry, James L.; Finnen, Daniel C.; Pinkerton, A. Alan
2,2'-Biadamantane
Acta Crystallographica Section C
50(2)
(1994)
267-269 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,502 | 8.651 | 0.004 | 19.133 | 0.019 | 10.832 | 0.006 | 90 | null | 99.76 | 0.04 | 90 | null | 1,767 | 2 | 295 | null | null | null | null | null | null | null | 5 | P 1 21 1 | null | - C35 H43 N2 O9 P - | - C36 H48 N2 O9 P - | - C72 H96 N4 O18 P2 - | 2 | 1 | ST1082 | Capron, Mark A.; McEldoon, Wenkui L.; Baenziger, Norman C.; Wiemer, David F. | Structure of a modified nucleoside, 3'α-diethylphosphono-3'β-hydroxy-5'-<i>O</i>-tritylthymidine | Acta Crystallographica Section C | 1,994 | 50 | 2 | 291 | 294 | 10.1107/S0108270193008662 | 0.71073 | MoKα | null | 0.066 | null | null | 0.097 | null | null | null | null | 1.14 | 1.14 | null | null | null | has coordinates | Capron, Mark A.; McEldoon, Wenkui L.; Baenziger, Norman C.; Wiemer, David F.
Structure of a modified nucleoside, 3'α-diethylphosphono-3'β-hydroxy-5'-<i>O</i>-tritylthymidine
Acta Crystallographica Section C
50(2)
(1994)
291-294 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,503 | 6.502 | 0.008 | 9.682 | 0.005 | 28.629 | 0.003 | 90 | null | 90 | null | 90 | null | 1,802 | 2 | 295 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C16 H28 N4 O3 - | - C16 H28 N4 O3 - | - C64 H112 N16 O12 - | 4 | 1 | VJ1000 | Di Blasio, B.; Nastri, F.; Saviano, M.; Benedetti, E.; Crisma, M.; Toniolo, C.; Johnson, R.L. | Structure of the tripeptide amide H-<small>L</small>-Pro-<small>L</small>-Leu-<small>L</small>-Pro-NH~2~, a dopamine receptor modulating agent | Acta Crystallographica Section C | 1,994 | 50 | 2 | 250 | 252 | 10.1107/S0108270193006808 | 1.5418 | CuKα | null | 0.042 | null | null | 0.043 | null | null | null | null | 0.672 | 0.672 | null | null | null | has coordinates | Di Blasio, B.; Nastri, F.; Saviano, M.; Benedetti, E.; Crisma, M.; Toniolo, C.; Johnson, R.L.
Structure of the tripeptide amide H-<small>L</small>-Pro-<small>L</small>-Leu-<small>L</small>-Pro-NH~2~, a dopamine receptor modulating agent
Acta Crystallographica Section C
50(2)
(1994)
250-252 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,504 | 11.592 | 0.001 | 8.031 | 0.002 | 15.597 | 0.001 | 90 | null | 109.32 | 0.02 | 90 | null | 1,370.2 | 0.4 | 293 | null | null | null | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | - C29 H34 O11 - | - C29 H34 O11 - | - C58 H68 O22 - | 2 | 1 | AB1044 | Sekar, K.; Parthasarathy, S.; Mathuram, V. | Structure of trijugin A | Acta Crystallographica Section C | 1,994 | 50 | 3 | 460 | 462 | 10.1107/S0108270193008431 | 1.5418 | CuKα | null | 0.042 | null | null | 0.05 | null | null | null | null | 1.089 | 1.089 | null | null | null | has coordinates | Sekar, K.; Parthasarathy, S.; Mathuram, V.
Structure of trijugin A
Acta Crystallographica Section C
50(3)
(1994)
460-462 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,505 | 8.952 | 0.005 | 21.979 | 0.004 | 15.709 | 0.003 | 90 | null | 90 | null | 90 | null | 3,090.8 | 1.9 | 293 | null | null | null | null | null | null | null | 5 | P c a b | -P 2bc 2ac | 61 | - C18 H15 N O3 S - | - C18 H15 N O3 S - | - C144 H120 N8 O24 S8 - | 8 | 1 | AB1076 | Hökelek, T.; Patir, S.; Gülce, A.; Okay, G. | Structural investigations of 1,2,3,4-tetrahydrocarbazole derivatives. I. 2,3-Dihydro-9-(phenylsulfonyl)carbazole-4(1<i>H</i>)-one and 1,2,3,4-tetrahydrocarbazole-1-spiro-2'-[1,3]dithiolane | Acta Crystallographica Section C | 1,994 | 50 | 3 | 450 | 453 | 10.1107/S0108270193007516 | 0.71069 | MoKα | null | 0.033 | null | null | 0.032 | null | null | null | null | null | null | null | null | null | has coordinates | Hökelek, T.; Patir, S.; Gülce, A.; Okay, G.
Structural investigations of 1,2,3,4-tetrahydrocarbazole derivatives. I. 2,3-Dihydro-9-(phenylsulfonyl)carbazole-4(1<i>H</i>)-one and 1,2,3,4-tetrahydrocarbazole-1-spiro-2'-[1,3]dithiolane
Acta Crystallographica Section C
50(3)
(1994)
450-453 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,829 | 15.415 | 0.005 | 9.616 | 0.006 | 21.659 | 0.004 | 90 | null | 109.91 | 0.02 | 90 | null | 3,019 | 2 | 296.2 | null | 296.2 | null | null | null | null | null | 6 | P 1 21/c 1 | -P 2ybc | 14 | - C21 H30 Ag3 N S6 W2 - | - C21 H30 Ag3 N S6 W2 - | - C84 H120 Ag12 N4 S24 W8 - | 4 | 1 | Jian-Ping Lang; Kazuyuki Tatsumi | Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4 | Inorganic Chemistry | 1,999 | 38 | 1364 | 1367 | 10.1021/ic980883j | 0.7107 | MoKα | 0 | 0 | null | null | 0 | 0.0542 | null | null | null | null | null | 1.526 | null | null | has coordinates | Jian-Ping Lang; Kazuyuki Tatsumi
Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4
Inorganic Chemistry
38
(1999)
1364-1367 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,506 | 9.715 | 0.002 | 6.721 | 0.002 | 19.854 | 0.008 | 90 | null | 91.29 | 0.03 | 90 | null | 1,296 | 0.7 | 293 | null | null | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | null | - C14 H15 N S2 - | - C14 H15 N S2 - | - C56 H60 N4 S8 - | 4 | 1 | AB1076 | Hökelek, T.; Patir, S.; Gülce, A.; Okay, G. | Structural investigations of 1,2,3,4-tetrahydrocarbazole derivatives. I. 2,3-Dihydro-9-(phenylsulfonyl)carbazole-4(1<i>H</i>)-one and 1,2,3,4-tetrahydrocarbazole-1-spiro-2'-[1,3]dithiolane | Acta Crystallographica Section C | 1,994 | 50 | 3 | 450 | 453 | 10.1107/S0108270193007516 | 1.5418 | CuKα | null | 0.054 | null | null | 0.067 | null | null | null | null | null | null | null | null | null | has coordinates | Hökelek, T.; Patir, S.; Gülce, A.; Okay, G.
Structural investigations of 1,2,3,4-tetrahydrocarbazole derivatives. I. 2,3-Dihydro-9-(phenylsulfonyl)carbazole-4(1<i>H</i>)-one and 1,2,3,4-tetrahydrocarbazole-1-spiro-2'-[1,3]dithiolane
Acta Crystallographica Section C
50(3)
(1994)
450-453 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,507 | 11.933 | 0.002 | 16.4 | 0.003 | 9.471 | 0.003 | 92.2 | 0.02 | 118.15 | 0.02 | 93.85 | 0.03 | 1,625.4 | 0.7 | 293 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C14 H21 Cl9 N6 O P6 - | - C14 H20 Cl9 N6 O P6 - | - C28 H40 Cl18 N12 O2 P12 - | 2 | 1 | AB1081 | Hökelek, T.; Kiliç, Z.; Kiliç, A. | 2-(2,6-Di-<i>tert</i>-butylphenoxy)-2',4,4,4',4',6,6,6',6'-nonachloro-2,2'-bi(cyclotri-λ^5^-phosphazene) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 453 | 456 | 10.1107/S0108270193008443 | 1.5418 | CuKα | null | 0.061 | null | null | 0.069 | null | null | null | null | null | null | null | null | null | has coordinates | Hökelek, T.; Kiliç, Z.; Kiliç, A.
2-(2,6-Di-<i>tert</i>-butylphenoxy)-2',4,4,4',4',6,6,6',6'-nonachloro-2,2'-bi(cyclotri-λ^5^-phosphazene)
Acta Crystallographica Section C
50(3)
(1994)
453-456 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,508 | 10.0464 | 0.0008 | 5.8561 | 0.0004 | 14.8215 | 0.0013 | 90 | null | 103.629 | 0.012 | 90 | null | 847.44 | 0.12 | 30 | null | 30 | null | null | null | null | null | 4 | A 1 2/a 1 | -A 2ya | 15 | Tripotassium hydrogenbis(selenate) | - H K3 O8 Se2 - | - H2 K3 O8 Se2 - | - H8 K12 O32 Se8 - | 4 | 0.5 | AB1083 | Ichikawa, Mizuhiko; Gustafsson, Torbjörn; Olovsson, Ivar | K~3~H(SeO~4~)~2~ at 297 and 30 K | Acta Crystallographica Section C | 1,994 | 50 | 3 | 330 | 332 | 10.1107/S0108270193009709 | 0.71073 | MoKα | 0.0557 | 0.0549 | null | null | 0.0648 | null | null | null | null | 1.41 | 1.41 | null | null | null | has coordinates | Ichikawa, Mizuhiko; Gustafsson, Torbjörn; Olovsson, Ivar
K~3~H(SeO~4~)~2~ at 297 and 30 K
Acta Crystallographica Section C
50(3)
(1994)
330-332 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,509 | 10.1325 | 0.0005 | 5.9042 | 0.0003 | 14.962 | 0.0007 | 90 | null | 103.638 | 0.007 | 90 | null | 869.85 | 0.08 | 297 | null | 297 | null | null | null | null | null | 4 | A 1 2/a 1 | -A 2ya | 15 | Tripotassium hydrogenbis(selenate) | - H K3 O8 Se2 - | - H2 K3 O8 Se2 - | - H8 K12 O32 Se8 - | 4 | 0.5 | AB1083 | Ichikawa, Mizuhiko; Gustafsson, Torbjörn; Olovsson, Ivar | K~3~H(SeO~4~)~2~ at 297 and 30 K | Acta Crystallographica Section C | 1,994 | 50 | 3 | 330 | 332 | 10.1107/S0108270193009709 | 0.71073 | MoKα | null | 0.0855 | null | null | 0.0561 | null | null | null | null | 1.2 | 1.2 | null | null | null | has coordinates | Ichikawa, Mizuhiko; Gustafsson, Torbjörn; Olovsson, Ivar
K~3~H(SeO~4~)~2~ at 297 and 30 K
Acta Crystallographica Section C
50(3)
(1994)
330-332 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,828 | 8.187 | 0.005 | 17.193 | 0.004 | 10.9 | 0.003 | 90 | null | 109.68 | 0.04 | 90 | null | 1,444.7 | 1.1 | 295 | null | 295 | null | null | null | null | null | ? | 6 | P 1 21/m 1 | -P 2yb | 11 | - C27 H40 B F4 Ir O6 - | - C27 B F4 Ir O6 - | - C54 B2 F8 Ir2 O12 - | 2 | 0.5 | H. Amouri; J. Vaissermann; M. N. Rager; Y. Besace | Unusual Me-O Bond Cleavage in a Metalated Crown-Ether: X-ray Molecular Structure of (5-Methoxy-4,6-dimethyl-1,3-xylylene-2-one)-15 Crown-4 Complex of Pentamethylcyclopentadienyl Iridium | Inorganic Chemistry | 1,999 | 38 | 1211 | 1215 | 10.1021/ic980811s | 0.71069 | MoKα | null | 0.0356 | null | null | 0.0433 | null | null | null | null | 3.8 | 3.8 | null | null | null | has coordinates | H. Amouri; J. Vaissermann; M. N. Rager; Y. Besace
Unusual Me-O Bond Cleavage in a Metalated Crown-Ether: X-ray Molecular Structure of (5-Methoxy-4,6-dimethyl-1,3-xylylene-2-one)-15 Crown-4 Complex of Pentamethylcyclopentadienyl Iridium
Inorganic Chemistry
38
(1999)
1211-1215 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,510 | 11.6712 | 0.001 | 18.4964 | 0.001 | 15.406 | 0.001 | 90 | null | 113.66 | 0.01 | 90 | null | 3,046.2 | 0.4 | 150 | null | 150 | null | null | null | null | null | 7 | P 1 21/c 1 | -P 2ybc | 14 | (2,2'-biquinoline)chloro(2,2':6',2"-terpyridine)ruthenium(II) | - C33 H23 Cl F6 N5 P Ru - | - C33 H23 Cl F6 N5 P Ru - | - C132 H92 Cl4 F24 N20 P4 Ru4 - | 4 | 1 | AB1107 | Spek, Anthony L.; Gerli, Alessandra; Reedijk, Jan | (2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')chloro(2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')ruthenium(II) hexafluorophosphate, [RuCl(C~18~H~12~N~2~)(C~15~H~11~N~3~)][PF~6~] | Acta Crystallographica Section C | 1,994 | 50 | 3 | 394 | 397 | 10.1107/S0108270193010236 | 0.71073 | MoKα | null | 0.067 | null | null | 0.066 | null | null | null | null | 3.79 | 3.79 | null | null | null | has coordinates | Spek, Anthony L.; Gerli, Alessandra; Reedijk, Jan
(2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')chloro(2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')ruthenium(II) hexafluorophosphate, [RuCl(C~18~H~12~N~2~)(C~15~H~11~N~3~)][PF~6~]
Acta Crystallographica Section C
50(3)
(1994)
394-397 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,511 | 19.646 | 0.002 | 6.149 | 0.001 | 11.466 | 0.002 | 90 | null | 95.25 | 0.01 | 90 | null | 1,379.3 | 0.4 | 295 | null | 295 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | 1-t-Butyl-(t-butylamino)-2-methylidene)-3-pyrrolidinone | - C13 H24 N2 O - | - C13 H24 N2 O - | - C52 H96 N8 O4 - | 4 | 1 | AB1111 | Spek, Anthony L.; Janssen, Maurits D.; Wissing, Elmo; Van Koten, G. | 1-<i>tert</i>-Butyl-2-(<i>tert</i>-butylaminomethylidene)-3-pyrrolidinone, C~13~H~24~N~2~O | Acta Crystallographica Section C | 1,994 | 50 | 3 | 410 | 411 | 10.1107/S0108270193010248 | 0.71073 | MoKα | null | 0.0555 | null | null | 0.0478 | null | null | null | null | 0.62 | 0.62 | null | null | null | has coordinates | Spek, Anthony L.; Janssen, Maurits D.; Wissing, Elmo; Van Koten, G.
1-<i>tert</i>-Butyl-2-(<i>tert</i>-butylaminomethylidene)-3-pyrrolidinone, C~13~H~24~N~2~O
Acta Crystallographica Section C
50(3)
(1994)
410-411 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,512 | 11.282 | 0.004 | 18.801 | 0.004 | 20.592 | 0.006 | 90 | null | 94.19 | 0.03 | 90 | null | 4,356 | 2 | 293 | null | null | null | null | null | null | null | 7 | P 1 21/n 1 | -P 2yn | 14 | - C40 H50 F6 Ir N O9 P2 - | - C40 H50 F6 Ir N O9 P2 - | - C160 H200 F24 Ir4 N4 O36 P8 - | 4 | 1 | AL1063 | Bedford, R.B.; Chaloner, P.A.; Hitchcock, P.B.; Al-Juaid, S.S. | An iridium complex of tris(2,4,6-trimethoxyphenyl)phosphine | Acta Crystallographica Section C | 1,994 | 50 | 3 | 356 | 358 | 10.1107/S0108270193009424 | 0.71069 | MoKα | null | 0.035 | null | null | 0.039 | null | null | null | null | 1.46 | 1.46 | null | null | null | has coordinates | Bedford, R.B.; Chaloner, P.A.; Hitchcock, P.B.; Al-Juaid, S.S.
An iridium complex of tris(2,4,6-trimethoxyphenyl)phosphine
Acta Crystallographica Section C
50(3)
(1994)
356-358 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,513 | 24.842 | 0.005 | 22.471 | 0.004 | 24.656 | 0.005 | 90 | null | 111.16 | 0.03 | 90 | null | 12,836 | 5 | 153 | 2 | 153 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | hexakis(2,4,6-tris(trifluoromethyl)phenyl)-cyclotristannoxane | - C54 H12 F54 O3 Sn3 - | - C54 H12 F54 O3 Sn3 - | - C432 H96 F432 O24 Sn24 - | 8 | 2 | AL1066 | Van der Maelen Uría, Juan F.; Belay, Maekele; Edelmann, Frank T.; Sheldrick, George M. | {Hexakis[2,4,6-tris(trifluoromethyl)phenyl]cyclotristannoxane}~2~ | Acta Crystallographica Section C | 1,994 | 50 | 3 | 403 | 407 | 10.1107/S0108270193008455 | 0.71073 | MoKα | 0.0594 | 0.0456 | null | 0.1227 | 0.1141 | null | null | null | 1.035 | 1.074 | 1.074 | null | null | null | has coordinates,has disorder | Van der Maelen Uría, Juan F.; Belay, Maekele; Edelmann, Frank T.; Sheldrick, George M.
{Hexakis[2,4,6-tris(trifluoromethyl)phenyl]cyclotristannoxane}~2~
Acta Crystallographica Section C
50(3)
(1994)
403-407 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,514 | 9.507 | 0.002 | 9.865 | 0.002 | 13.262 | 0.003 | 98.774 | 0.014 | 93.82 | 0.02 | 97.97 | 0.02 | 1,212.5 | 0.5 | 295 | 2 | 295 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | (N,N,N',N'-tetrakis(pyrazol-1ylmethyl)-1,2-diaminoethane)-disilver(I) dinitrate ? | - C18 H24 Ag2 N12 O6 - | - C18 H24 Ag2 N12 O6 - | - C36 H48 Ag4 N24 O12 - | 2 | 1 | AL1072 | Clegg, William; Cooper, Paul J.; Lockhart, Joyce C.; Rushton, David J. | A binuclear silver complex of a tetrapyrazolyl ligand | Acta Crystallographica Section C | 1,994 | 50 | 3 | 383 | 386 | 10.1107/S0108270193009400 | 0.71073 | MoKα | 0.0536 | 0.0399 | null | 0.1138 | 0.0945 | null | null | null | 1.072 | 1.058 | 1.058 | null | null | null | has coordinates | Clegg, William; Cooper, Paul J.; Lockhart, Joyce C.; Rushton, David J.
A binuclear silver complex of a tetrapyrazolyl ligand
Acta Crystallographica Section C
50(3)
(1994)
383-386 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,515 | 12.434 | 0.002 | 10.244 | 0.002 | 11.134 | 0.002 | 90 | null | 100.851 | 0.014 | 90 | null | 1,392.8 | 0.4 | 295 | 2 | 295 | 2 | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | 14 | - C13 H13 Br Cl2 O2 - | - C13 H13 Br Cl2 O2 - | - C52 H52 Br4 Cl8 O8 - | 4 | 1 | AL1073 | Brown, Philip E.; Clegg, William; Steele, John E. | Structure of a cyclopropachromene | Acta Crystallographica Section C | 1,994 | 50 | 3 | 424 | 425 | 10.1107/S0108270193009436 | 1.54184 | CuKα | 0.0426 | 0.0414 | null | 0.1213 | 0.1196 | null | null | null | 1.105 | 1.121 | 1.121 | null | null | null | has coordinates | Brown, Philip E.; Clegg, William; Steele, John E.
Structure of a cyclopropachromene
Acta Crystallographica Section C
50(3)
(1994)
424-425 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,516 | 3.4185 | 0.0001 | 3.4185 | 0.0001 | 25.463 | 0.003 | 90 | null | 90 | null | 120 | null | 257.7 | 0.03 | 295 | null | null | null | null | null | null | null | 4 | R -3 m | -R 3 2" | null | - Fe Lu O4 Zn - | - Fe Lu O4 Zn - | - Fe3 Lu3 O12 Zn3 - | 3 | null | AS1025 | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T. | Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 332 | 336 | 10.1107/S0108270193008108 | 0.71073 | MoKα | null | 0.036 | null | null | 0.036 | null | null | null | null | 2.3 | 2.3 | null | null | null | has coordinates | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T.
Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6)
Acta Crystallographica Section C
50(3)
(1994)
332-336 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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4,321,827 | 10.0295 | 0.0005 | 26.3564 | 0.0013 | 14.1032 | 0.0007 | 90 | null | 94.6914 | 0.001 | 90 | null | 3,715.6 | 0.3 | 153 | 2 | 293 | 2 | null | null | null | null | 7 | P 1 21 1 | P 2yb | 4 | [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] | Di-(Bis-triphenylphosphonium iminium)(hexacarbonyl μ-sulfur dioxide diferrate) | - C80 H63 Fe2 N3 O10 P4 S2 - | - C80 H63 Fe2 N3 O10 P4 S2 - | - C160 H126 Fe4 N6 O20 P8 S4 - | 2 | 1 | Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver | New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors. | Inorganic Chemistry | 1,999 | 38 | 1282 | 1287 | 10.1021/ic980762j | 0.71069 | MoKα | 0.0889 | 0.0663 | null | null | 0.1717 | 0.1825 | null | null | null | null | null | 0.996 | null | null | has coordinates | Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver
New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors.
Inorgani... | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,517 | 3.3406 | 0.0001 | 3.3406 | 0.0001 | 32.51 | 0.02 | 90 | null | 90 | null | 120 | null | 314.19 | 0.19 | 295 | null | null | null | null | null | null | null | 4 | P 63/m m c | -P 6c 2c | null | - Fe Lu O7 Zn4 - | - Fe0.5 Lu O7 Zn4.5 - | - Fe Lu2 O14 Zn9 - | 2 | 0.083333 | AS1025 | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T. | Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 332 | 336 | 10.1107/S0108270193008108 | 0.71073 | MoKα | null | 0.05 | null | null | 0.057 | null | null | null | null | 2.6 | 2.6 | null | null | null | has coordinates | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T.
Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6)
Acta Crystallographica Section C
50(3)
(1994)
332-336 | 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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2,009,518 | 3.3291 | 0.0001 | 3.3291 | 0.0001 | 56.56 | 0.02 | 90 | null | 90 | null | 120 | null | 542.87 | 0.19 | 295 | null | null | null | null | null | null | null | 4 | R -3 m | -R 3 2" | null | - Fe Lu O8 Zn5 - | - Fe Lu O8 Zn5 - | - Fe3 Lu3 O24 Zn15 - | 3 | null | AS1025 | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T. | Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 332 | 336 | 10.1107/S0108270193008108 | 0.71073 | MoKα | null | 0.046 | null | null | 0.053 | null | null | null | null | 4.2 | 4.2 | null | null | null | has coordinates | Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T.
Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6)
Acta Crystallographica Section C
50(3)
(1994)
332-336 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,519 | 15.773 | 0.009 | 12.402 | 0.015 | 12.989 | 0.006 | 90 | null | 102.72 | 0.06 | 90 | null | 2,479 | 4 | 293 | null | null | null | null | null | null | null | 5 | C 1 2 1 | C 2y | null | - C36 H55 N8 O8 S2 - | - C37 H52 N8 O11 S2 - | - C74 H104 N16 O22 S4 - | 2 | 0.5 | AS1063 | In, Y.; Doi, M.; Inoue, M.; Ishida, T.; Hamada, Y.; Shioiri, T. | Patellamide A, a cytotoxic cyclic peptide from the ascidian <i>Lissoclinum patella</i> | Acta Crystallographica Section C | 1,994 | 50 | 3 | 432 | 434 | 10.1107/S010827019300811X | 1.5418 | CuKα | null | 0.064 | null | null | 0.088 | null | null | null | null | 0.7885 | 0.7885 | null | null | null | has coordinates | In, Y.; Doi, M.; Inoue, M.; Ishida, T.; Hamada, Y.; Shioiri, T.
Patellamide A, a cytotoxic cyclic peptide from the ascidian <i>Lissoclinum patella</i>
Acta Crystallographica Section C
50(3)
(1994)
432-434 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
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2,009,520 | 12.945 | 0.002 | 20.212 | 0.004 | 12.882 | 0.003 | 98.5 | 0.02 | 102.19 | 0.02 | 101.11 | 0.02 | 3,169.7 | 1.2 | 296 | null | 296 | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | Hexasodium Trihydrogen Decatungstosamarate Octacosahydrate | - H59 Na6 O64 Sm W10 - | - Na6 O64 Sm W10 - | - Na12 O128 Sm2 W20 - | 2 | 1 | AS1081 | Ozeki, Tomoji; Yamase, Toshihiro | Hexasodium trihydrogen decatungstosamarate octacosahydrate | Acta Crystallographica Section C | 1,994 | 50 | 3 | 327 | 330 | 10.1107/S0108270193009965 | 0.71069 | MoKα | null | 0.049 | null | null | 0.06 | null | null | null | null | 1.76 | 1.76 | null | null | null | has coordinates | Ozeki, Tomoji; Yamase, Toshihiro
Hexasodium trihydrogen decatungstosamarate octacosahydrate
Acta Crystallographica Section C
50(3)
(1994)
327-330 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
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2,009,521 | 8.413 | 0.005 | 16.859 | 0.008 | 19.184 | 0.003 | 94.08 | 0.04 | 96.59 | 0.04 | 91.44 | 0.04 | 2,695 | 2 | 225 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C55 H66 Cl3 D I2 Sn2 - | - C55 H47 Cl3 D I2 Sn2 - | - C110 H94 Cl6 D2 I4 Sn4 - | 2 | 1 | BR1044 | Simard, M.G.; Wharf, I. | Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide | Acta Crystallographica Section C | 1,994 | 50 | 3 | 397 | 403 | 10.1107/S0108270193008935 | 0.71073 | MoKᾱ | null | 0.045 | null | null | 0.052 | null | null | null | null | 3 | 3 | null | null | null | has coordinates | Simard, M.G.; Wharf, I.
Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide
Acta Crystallographica Section C
50(3)
(1994)
397-403 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,009,522 | 8.6431 | 0.0013 | 16.823 | 0.002 | 19.97 | 0.002 | 77.738 | 0.011 | 84.234 | 0.011 | 89.421 | 0.012 | 2,822.9 | 0.6 | 295 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C61 H74 I2 Sn2 - | - C68 H82 I2 Sn2 - | - C136 H164 I4 Sn4 - | 2 | 1 | BR1044 | Simard, M.G.; Wharf, I. | Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide | Acta Crystallographica Section C | 1,994 | 50 | 3 | 397 | 403 | 10.1107/S0108270193008935 | null | MoKᾱ | null | 0.068 | null | null | 0.079 | null | null | null | null | 2.28 | 2.28 | null | null | null | has coordinates | Simard, M.G.; Wharf, I.
Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide
Acta Crystallographica Section C
50(3)
(1994)
397-403 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,009,523 | 9.8737 | 0.0012 | 9.9216 | 0.0016 | 18.799 | 0.003 | 83.928 | 0.014 | 78.372 | 0.012 | 76.748 | 0.011 | 1,752.3 | 0.5 | 295 | null | null | null | null | null | null | null | 4 | P -1 | -P 1 | 2 | - C18 H15 I Sn - | - C18 H15 I Sn - | - C72 H60 I4 Sn4 - | 4 | 2 | BR1044 | Simard, M.G.; Wharf, I. | Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide | Acta Crystallographica Section C | 1,994 | 50 | 3 | 397 | 403 | 10.1107/S0108270193008935 | 1.54108 | CuKᾱ | null | 0.037 | null | null | 0.039 | null | null | null | null | 1.62 | 1.62 | null | null | null | has coordinates | Simard, M.G.; Wharf, I.
Comparison of the structures of two trimesityltin iodide solvates and triphenyltin iodide
Acta Crystallographica Section C
50(3)
(1994)
397-403 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
#$Date: 2022-09-28 18:08:17 +0300 (Wed, 28 Sep 2022) $
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2,009,524 | 9.805 | 0.006 | 19.88 | 0.006 | 13.353 | 0.003 | 90 | null | 124.48 | 0.03 | 90 | null | 2,145.6 | 1.5 | 295 | null | null | null | null | null | null | null | 5 | P 21/c | -P 2ybc | null | - C21 H21 I O3 Sn - | 4 | null | Simard, M. G.; Wharf, I. | A Comparison of the Structures of Two Trimesityltin Iodide Solvates and Triphenyltin Iodide | Acta Crystallographica Section C | 1,994 | 50 | 3 | 397 | 403 | 10.1107/S0108270193008935 | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | Simard, M. G.; Wharf, I.
A Comparison of the Structures of Two Trimesityltin Iodide Solvates and Triphenyltin Iodide
Acta Crystallographica Section C
50(3)
(1994)
397-403 | 278,158 | 2022-09-26 | 15:28:11 | #------------------------------------------------------------------------------
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2,009,525 | 8.1 | 0.002 | 31.729 | 0.005 | 7.848 | 0.003 | 90 | null | 90 | null | 90 | null | 2,017 | 1 | 294 | null | 294 | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | 19 | Dimethyl 9-phenyl-1,4-dihydro-1,4-ethenoanthracene-11,12-dicarboxylate | - C26 H20 O4 - | - C26 H20 O4 - | - C104 H80 O16 - | 4 | 1 | BR1057 | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James | Dimethyl 9-phenyl-1,4-dihydro-1,4-ethenoanthracene-11,12-dicarboxylate | Acta Crystallographica Section C | 1,994 | 50 | 3 | 415 | 417 | 10.1107/S0108270193010054 | 1.5418 | CopperKα | 0.061 | 0.04 | null | 0.057 | 0.056 | null | null | null | null | 1.81 | 1.81 | null | null | null | has coordinates | Pokkuluri, Phani Raj; Scheffer, John R.; Trotter, James
Dimethyl 9-phenyl-1,4-dihydro-1,4-ethenoanthracene-11,12-dicarboxylate
Acta Crystallographica Section C
50(3)
(1994)
415-417 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,826 | 29.7648 | 0.0003 | 14.6496 | 0.0001 | 21.762 | 0.0003 | 90 | null | 123.397 | 0.001 | 90 | null | 7,922.27 | 0.17 | 298 | 2 | 298 | 2 | null | null | null | null | 8 | C 1 c 1 | C -2yc | 9 | [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)] | Di-(Bis-triphenylphosphonium iminium)(nona-carbonyl-μ~3~,η^2^-sulfur dioxide tri-ferrate) | - C81.5 H61 Cl Fe3 N2 O11 P4 S - | - C81.5 H61 Cl Fe3 N2 O11 P4 S - | - C326 H244 Cl4 Fe12 N8 O44 P16 S4 - | 4 | 1 | Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver | New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors. | Inorganic Chemistry | 1,999 | 38 | 1282 | 1287 | 10.1021/ic980762j | 0.71073 | MoKα | 0.0656 | 0.0505 | null | 0.125 | 0.118 | null | null | null | 1.432 | 1.51 | 1.51 | null | null | null | has coordinates | Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver
New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors.
Inorgani... | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,526 | 6.6289 | 0.0005 | 12.5448 | 0.0014 | 49.81 | 0.004 | 90 | null | 90.068 | 0.006 | 90 | null | 4,142.1 | 0.6 | 294 | 1 | null | null | null | null | null | null | 3 | P 1 21 1 | P 2yb | 4 | (20R,23S,24R)-5α-dinosteran-29-ol | - C30 H54 O - | - C30 H53 O - | - C180 H318 O6 - | 6 | 3 | CR1061 | Brock, Carolyn Pratt; Stoilov, Ivan; Watt, David S. | A steroid derivative that crystallizes with three molecules in the asymmetric unit | Acta Crystallographica Section C | 1,994 | 50 | 3 | 434 | 438 | 10.1107/S0108270193009230 | 0.7107 | MoKα | null | 0.075 | null | null | 0.068 | null | null | null | null | 2.62 | 2.62 | null | null | null | has coordinates | Brock, Carolyn Pratt; Stoilov, Ivan; Watt, David S.
A steroid derivative that crystallizes with three molecules in the asymmetric unit
Acta Crystallographica Section C
50(3)
(1994)
434-438 | 205,898 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,527 | 20.935 | 0.003 | 22.391 | 0.003 | 9.756 | 0.003 | 90 | null | 90 | null | 90 | null | 4,573.2 | 1.7 | 293 | null | null | null | null | null | null | null | 5 | P b c a | -P 2ac 2ab | null | - C23 H20 Br3 N3 O2 - | - C23 H20 Br3 N3 O2 - | - C184 H160 Br24 N24 O16 - | 8 | 1 | CR1063 | Jircitano, A.J.; Sommerer, S.O.; Shelley, J.J.; Westcott, B.L.; Suh, Il-Hwan | The self-condensation of a derivative of <i>o</i>-aminobenzaldehyde. Structure of the polycyclic bisanhydro trimer of 2-amino-5-bromobenzaldehyde | Acta Crystallographica Section C | 1,994 | 50 | 3 | 445 | 447 | 10.1107/S0108270193006894 | 0.71069 | MoKα | null | 0.083 | null | null | 0.0895 | null | null | null | null | 0.9352 | 0.9352 | null | null | null | has coordinates | Jircitano, A.J.; Sommerer, S.O.; Shelley, J.J.; Westcott, B.L.; Suh, Il-Hwan
The self-condensation of a derivative of <i>o</i>-aminobenzaldehyde. Structure of the polycyclic bisanhydro trimer of 2-amino-5-bromobenzaldehyde
Acta Crystallographica Section C
50(3)
(1994)
445-447 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,528 | 8.866 | 0.001 | 9.534 | 0.001 | 9.245 | 0.001 | 90 | null | 92.92 | 0.01 | 90 | null | 780.45 | 0.15 | 296 | null | 296 | null | null | null | null | null | 5 | P 1 21 1 | null | (4aR,8R,SR)-4a-Hydroxy-8-(p-tolylsulfinyl)- 2,3,4,4a,5,6,7,8-octahydroquinoline | - C16 H21 N O2 S - | - C16 H21 N O2 S - | - C32 H42 N2 O4 S2 - | 2 | 1 | CR1077 | Robinson, Paul D.; Hua, Duy H.; Wang, Hui; Chen, Jin Shan; Good, Linda A. | (4a<i>R</i>,8<i>R</i>,S<i>R</i>)-8-(<i>p</i>-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol | Acta Crystallographica Section C | 1,994 | 50 | 3 | 425 | 428 | 10.1107/S0108270193009321 | 0.71069 | MoKα | null | 0.03 | null | null | 0.035 | null | null | null | null | 1.4 | 1.4 | null | null | null | has coordinates | Robinson, Paul D.; Hua, Duy H.; Wang, Hui; Chen, Jin Shan; Good, Linda A.
(4a<i>R</i>,8<i>R</i>,S<i>R</i>)-8-(<i>p</i>-Tolylsulfinyl)-2,3,4,4a,5,6,7,8-octahydro-4a-quinolinol
Acta Crystallographica Section C
50(3)
(1994)
425-428 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,529 | 10.689 | 0.001 | 17.448 | 0.003 | 8.976 | 0.001 | 90 | null | 90 | null | 90 | null | 1,674 | 0.4 | 296 | null | 296 | null | null | null | null | null | 4 | P c c n | -P 2ab 2ac | 56 | bis(4-methoxyphenylmethyine)carbonic dihydrazide | - C17 H18 N4 O3 - | - C17 H18 N4 O3 - | - C68 H72 N16 O12 - | 4 | 0.5 | CR1083 | Kolb, Vera M.; Robinson, Paul D.; Meyers, Cal Y. | Intermolecular hydrogen-bonded structure of bis(4-methoxyphenylmethine)carbonohydrazide | Acta Crystallographica Section C | 1,994 | 50 | 3 | 417 | 419 | 10.1107/S0108270193010078 | 0.71069 | MoKα | null | 0.045 | null | null | 0.057 | null | null | null | null | 1.8 | 1.8 | null | null | null | has coordinates | Kolb, Vera M.; Robinson, Paul D.; Meyers, Cal Y.
Intermolecular hydrogen-bonded structure of bis(4-methoxyphenylmethine)carbonohydrazide
Acta Crystallographica Section C
50(3)
(1994)
417-419 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,530 | 14.02 | 0.03 | 14.02 | 0.03 | 12.47 | 0.03 | 90 | null | 90 | null | 90 | null | 2,451 | 9 | 297 | null | null | null | null | null | null | null | 6 | P 4/n :2 | -P 4a | 85 | - C16 H41 Cl4 Cu N2 O0.5 - | - C16 H41 Cl4 Cu N2 O0.5 - | - C64 H164 Cl16 Cu4 N8 O2 - | 4 | 0.5 | DU1030 | Mahoui, A.; Lapasset, J.; Moret, J. | Structure du bis(tétraéthylammonium)tétrachlorocuprate(II) hémihydrate, [(C~2~H~5~)~4~N]~2~[CuCl~4~].0,5H~2~O | Acta Crystallographica Section C | 1,994 | 50 | 3 | 358 | 362 | 10.1107/S0108270193007280 | 1.5418 | Cu | null | 0.0573 | null | null | 0.0595 | null | null | null | null | 1.689 | 1.689 | null | null | null | has coordinates,has disorder | Mahoui, A.; Lapasset, J.; Moret, J.
Structure du bis(tétraéthylammonium)tétrachlorocuprate(II) hémihydrate, [(C~2~H~5~)~4~N]~2~[CuCl~4~].0,5H~2~O
Acta Crystallographica Section C
50(3)
(1994)
358-362 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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4,321,825 | 11.8522 | 0.0005 | 13.4689 | 0.0006 | 25.3911 | 0.0011 | 90 | null | 90 | null | 90 | null | 4,053.3 | 0.3 | 160 | 2 | 160 | 2 | null | null | null | null | 7 | P 21 21 21 | P 2ac 2ab | 19 | (mu!2$-iodo)-bis(mu!2$-pyrazolate-N,N')-bis(carbonyl-iodo-dimethyl phenylphosphine-rhodium(iii)) pentaiodide | - C24 H28 I8 N4 O2 P2 Rh2 - | - C24 H28 I8 N4 O2 P2 Rh2 - | - C96 H112 I32 N16 O8 P8 Rh8 - | 4 | 1 | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro | Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes | Inorganic Chemistry | 1,999 | 38 | 1108 | 1117 | 10.1021/ic980650s | 0.71073 | MoKα | 0.0437 | 0.0359 | null | null | 0.0856 | 0.0896 | null | null | null | null | null | 1.047 | null | null | has coordinates | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro
Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes
Inorganic Chemistry
38
(1999)
1108-1117 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,531 | 9.004 | 0.008 | 12.584 | 0.003 | 12.798 | 0.007 | 69.07 | 0.04 | 69.82 | 0.06 | 86.08 | 0.04 | 1,268.8 | 1.5 | 293 | null | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C14 H19 Cl4 Hg4 N O6 - | - C15 H19 Cl4 Hg4 N O6 - | - C30 H38 Cl8 Hg8 N2 O12 - | 2 | 1 | DU1049 | Toledano, P.; Bonhomme, C.; Henry, M.; Livage, J. | Structure d'un dérivé dimercuré de l'acétoacétate d'éthyle, [Hg~2~(C~6~H~8~O~3~)Cl~2~]~2~.CH~3~CN | Acta Crystallographica Section C | 1,994 | 50 | 3 | 365 | 367 | 10.1107/S0108270193009333 | 0.71069 | MoKᾱ | null | 0.0292 | null | null | 0.032 | null | null | null | null | 1.75 | 1.75 | null | null | null | has coordinates | Toledano, P.; Bonhomme, C.; Henry, M.; Livage, J.
Structure d'un dérivé dimercuré de l'acétoacétate d'éthyle, [Hg~2~(C~6~H~8~O~3~)Cl~2~]~2~.CH~3~CN
Acta Crystallographica Section C
50(3)
(1994)
365-367 | 278,247 | 2022-09-28 | 15:09:32 | #------------------------------------------------------------------------------
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2,009,532 | 7.974 | 0.004 | 11.96 | 0.004 | 16.482 | 0.008 | 90 | null | 90 | null | 90 | null | 1,571.9 | 1.2 | 294 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C21 H22 N2 O2 - | - C21 H22 N2 O2 - | - C84 H88 N8 O8 - | 4 | 1 | HA1064 | Beddoes, R.L.; Gorman, A.A.; Prescott, A.L. | Structure of neostrychnine. An enamine with a bridgehead nitrogen which undergoes efficient chemical reaction with singlet oxygen | Acta Crystallographica Section C | 1,994 | 50 | 3 | 447 | 450 | 10.1107/S0108270193008807 | 0.71069 | MoKα | null | 0.068 | null | null | 0.044 | null | null | null | null | 1.787 | 1.787 | null | null | null | has coordinates | Beddoes, R.L.; Gorman, A.A.; Prescott, A.L.
Structure of neostrychnine. An enamine with a bridgehead nitrogen which undergoes efficient chemical reaction with singlet oxygen
Acta Crystallographica Section C
50(3)
(1994)
447-450 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,533 | 9.821 | 0.002 | 12.576 | 0.003 | 15.068 | 0.005 | 104.63 | 0.02 | 97.21 | 0.02 | 105.98 | 0.02 | 1,692.6 | 0.8 | 293 | null | null | null | null | null | null | null | 7 | P -1 | -P 1 | 2 | - C34 H38 F6 Ir N O3 P2 - | - C34 H38 F6 Ir N O3 P2 - | - C68 H76 F12 Ir2 N2 O6 P4 - | 2 | 1 | HA1067 | Bedford, R.B.; Chaloner, P.A.; Hitchcock, P.B. | An iridium complex of tris(4-methoxyphenyl)phosphine | Acta Crystallographica Section C | 1,994 | 50 | 3 | 354 | 356 | 10.1107/S0108270193008819 | 0.71069 | MoKα | null | 0.033 | null | null | 0.04 | null | null | null | null | 1.2 | 1.2 | null | null | null | has coordinates | Bedford, R.B.; Chaloner, P.A.; Hitchcock, P.B.
An iridium complex of tris(4-methoxyphenyl)phosphine
Acta Crystallographica Section C
50(3)
(1994)
354-356 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,534 | 9.1175 | 0.0011 | 12.3971 | 0.0014 | 15.5602 | 0.0016 | 90 | null | 92.068 | 0.009 | 90 | null | 1,757.6 | 0.3 | 183 | null | null | null | null | null | null | null | 5 | P 1 21/n 1 | -P 2yn | 14 | - C15 H15 Cl3 N3 V - | - C15 H15 Cl3 N3 V - | - C60 H60 Cl12 N12 V4 - | 4 | 1 | HH1032 | Sorensen, K.L.; Ziller, J.W.; Doherty, N.M. | <i>mer</i>-Trichlorotris(pyridine)vanadium(III) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 407 | 409 | 10.1107/S0108270193005268 | 0.71073 | MoKα | null | 0.052 | null | null | 0.053 | null | null | null | null | 1.19 | 1.19 | null | null | null | has coordinates | Sorensen, K.L.; Ziller, J.W.; Doherty, N.M.
<i>mer</i>-Trichlorotris(pyridine)vanadium(III)
Acta Crystallographica Section C
50(3)
(1994)
407-409 | 278,324 | 2022-10-03 | 14:41:53 | #------------------------------------------------------------------------------
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2,009,535 | 8.693 | 0.0005 | 12.3768 | 0.0009 | 12.4624 | 0.0009 | 90 | null | 90 | null | 90 | null | 1,340.85 | 0.16 | 298 | null | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | null | - C13 H20 Br N O2 - | - C13 H20 Br N O2 - | - C52 H80 Br4 N4 O8 - | 4 | 1 | HH1076 | Garcia, J.G.; Fronczek, F.R.; Gandour, R.D. | 2-Hydroxy-4,4-dimethyl-2-(2-methylphenyl)morpholinium bromide, C~13~H~20~NO~2~^+^.Br^{-^} | Acta Crystallographica Section C | 1,994 | 50 | 3 | 430 | 432 | 10.1107/S0108270193006559 | 0.71073 | MoKα | null | 0.037 | null | null | 0.037 | null | null | null | null | 1.549 | 1.549 | null | null | null | has coordinates | Garcia, J.G.; Fronczek, F.R.; Gandour, R.D.
2-Hydroxy-4,4-dimethyl-2-(2-methylphenyl)morpholinium bromide, C~13~H~20~NO~2~^+^.Br^{-^}
Acta Crystallographica Section C
50(3)
(1994)
430-432 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,536 | 19.044 | 0.005 | 5.794 | 0.002 | 12.494 | 0.003 | 90 | null | 115.28 | 0.02 | 90 | null | 1,246.6 | 0.7 | null | null | null | null | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | null | - C16 H12 N2 - | - C16 H12 N2 - | - C64 H48 N8 - | 4 | 0.5 | HL1035 | Koh, L.L.; Yan,Xu; Sim, K.Y.; Liang, E.; Huang, H.H. | <i>meso</i>- and (±)-1,2-dicyano-1,2-diphenylethane | Acta Crystallographica Section C | 1,994 | 50 | 3 | 438 | 442 | 10.1107/S0108270193008121 | 0.71073 | MoKα | null | 0.046 | null | null | 0.043 | null | null | null | null | 1.74 | 1.74 | null | null | null | has coordinates | Koh, L.L.; Yan,Xu; Sim, K.Y.; Liang, E.; Huang, H.H.
<i>meso</i>- and (±)-1,2-dicyano-1,2-diphenylethane
Acta Crystallographica Section C
50(3)
(1994)
438-442 | 176,759 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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4,321,824 | 11.3869 | 0.0009 | 16.2642 | 0.0013 | 16.5072 | 0.0014 | 95.34 | 0.002 | 96.41 | 0.002 | 110.191 | 0.002 | 2,822.8 | 0.4 | 160 | 2 | 160 | 2 | null | null | null | null | 7 | P -1 | -P 1 | 2 | (mu!2$-pyrazolate-N,N')-(mu!2$-carbonyl)-(carbonyl-iodo-tritolylphosphine rhodium(iii))-(iodo-tritolylphosphine-rhodium(iii)) diethylether solvate | - C52 H53 I2 N4 O2.5 P2 Rh2 - | - C52 H53 I2 N4 O2.5 P2 Rh2 - | - C104 H106 I4 N8 O5 P4 Rh4 - | 2 | 1 | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro | Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes | Inorganic Chemistry | 1,999 | 38 | 1108 | 1117 | 10.1021/ic980650s | 0.71073 | MoKα | 0.0885 | 0.0504 | null | null | 0.1131 | 0.1289 | null | null | null | null | null | 1.019 | null | null | has coordinates | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro
Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes
Inorganic Chemistry
38
(1999)
1108-1117 | 176,467 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,537 | 17.702 | 0.006 | 5.72 | 0.002 | 12.725 | 0.004 | 90 | null | 104.58 | 0.03 | 90 | null | 1,247 | 0.7 | 298 | null | null | null | null | null | null | null | 3 | C 1 2/c 1 | -C 2yc | null | - C16 H12 N2 - | - C16 H12 N2 - | - C64 H48 N8 - | 4 | 0.5 | HL1035 | Koh, L.L.; Yan,Xu; Sim, K.Y.; Liang, E.; Huang, H.H. | <i>meso</i>- and (±)-1,2-dicyano-1,2-diphenylethane | Acta Crystallographica Section C | 1,994 | 50 | 3 | 438 | 442 | 10.1107/S0108270193008121 | 0.71073 | MoKα | null | 0.031 | null | null | 0.048 | null | null | null | null | 1.55 | 1.55 | null | null | null | has coordinates | Koh, L.L.; Yan,Xu; Sim, K.Y.; Liang, E.; Huang, H.H.
<i>meso</i>- and (±)-1,2-dicyano-1,2-diphenylethane
Acta Crystallographica Section C
50(3)
(1994)
438-442 | 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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2,009,538 | 11.441 | 0.004 | 16.666 | 0.001 | 10.251 | 0.003 | 90 | null | 115.34 | 0.01 | 90 | null | 1,766.6 | 0.8 | 293 | null | null | null | null | null | null | null | 5 | P 1 21 1 | P 2yb | 4 | - C36 H37 N3 O9 S - | - C36 H37 N3 O9 S - | - C72 H74 N6 O18 S2 - | 2 | 1 | HU1040 | Dianez, M.J.; Estrada, M.D.; Perez-Garrido, S.; Lopez-Castro, A. | 3-[(2<i>R</i>,3<i>R</i>)-3-(4-Dimethylaminophenyl)-2-phenyl-2,3-epithiopropanoyl]-1-phenyl-(3,5,6-tri-<i>O</i>-acetyl-1,2-dideoxy-α-<small>D</small>-glucofuranoso)[1,2-<i>d</i>]imidazolidin-2-one | Acta Crystallographica Section C | 1,994 | 50 | 3 | 442 | 444 | 10.1107/S0108270193010133 | 0.7107 | MoKα | null | 0.04 | null | null | 0.04 | null | null | null | null | 1.16 | 1.16 | null | null | null | has coordinates | Dianez, M.J.; Estrada, M.D.; Perez-Garrido, S.; Lopez-Castro, A.
3-[(2<i>R</i>,3<i>R</i>)-3-(4-Dimethylaminophenyl)-2-phenyl-2,3-epithiopropanoyl]-1-phenyl-(3,5,6-tri-<i>O</i>-acetyl-1,2-dideoxy-α-<small>D</small>-glucofuranoso)[1,2-<i>d</i>]imidazolidin-2-one
Acta Crystallographica Section C
50(3)
(1994)
442-444 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,539 | 15.995 | 0.005 | 12.958 | 0.007 | 9.732 | 0.004 | 90 | null | 90 | null | 90 | null | 2,017.1 | 1.5 | 298 | null | null | null | null | null | null | null | 5 | P n 21 a | P -2ac -2n | null | - C12 H9 O10 Os3 P - | - C14 O10 Os3 P - | - C56 O40 Os12 P4 - | 4 | 1 | HU1044 | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M. | A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands | Acta Crystallographica Section C | 1,994 | 50 | 3 | 371 | 375 | 10.1107/S010827019300767X | 0.71073 | MoKα | null | 0.0444 | null | null | 0.0477 | null | null | null | null | 1.106 | 1.106 | null | null | null | has coordinates | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M.
A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands
Acta Crystallographica Section C
50(3)
(1994)
371-375 | 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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2,009,540 | 8.86 | 0.003 | 16.408 | 0.011 | 13.779 | 0.011 | 90 | null | 103.4 | 0.06 | 90 | null | 1,949 | 2 | 298 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C12 H7 O10 Os3 P - | - C12 O10 Os3 P - | - C48 O40 Os12 P4 - | 4 | 1 | HU1044 | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M. | A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands | Acta Crystallographica Section C | 1,994 | 50 | 3 | 371 | 375 | 10.1107/S010827019300767X | 0.71073 | MoKα | null | 0.0376 | null | null | 0.0524 | null | null | null | null | 0.62 | 0.62 | null | null | null | has coordinates | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M.
A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands
Acta Crystallographica Section C
50(3)
(1994)
371-375 | 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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2,009,541 | 17.108 | 0.004 | 14.229 | 0.004 | 14.485 | 0.009 | 90 | null | 90 | null | 90 | null | 3,526 | 3 | 298 | null | null | null | null | null | null | null | 5 | P c a b | -P 2ab 2ac | null | - C10 H5 O9 Os3 P - | - C10 O9 Os3 P - | - C80 O72 Os24 P8 - | 8 | 1 | HU1044 | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M. | A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands | Acta Crystallographica Section C | 1,994 | 50 | 3 | 371 | 375 | 10.1107/S010827019300767X | 0.71073 | MoKα | null | 0.043 | null | null | 0.0526 | null | null | null | null | 1.076 | 1.076 | null | null | null | has coordinates | Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M.
A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands
Acta Crystallographica Section C
50(3)
(1994)
371-375 | 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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4,321,823 | 10.55 | 0.002 | 15.763 | 0.003 | 16.353 | 0.003 | 83.94 | 0.03 | 79.975 | 0.015 | 83.97 | 0.03 | 2,652.6 | 0.9 | 160 | 2 | 160 | 2 | null | null | null | null | 7 | P -1 | -P 1 | 2 | bis-(mu!2$-pyrazolate-N,N')-carbonyl-iodo-trimethylphosphite-rhodium(ii)) | - C14 H24 I2 N4 O8 P2 Rh2 - | - C14 H24 I2 N4 O8 P2 Rh2 - | - C56 H96 I8 N16 O32 P8 Rh8 - | 4 | 2 | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro | Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes | Inorganic Chemistry | 1,999 | 38 | 1108 | 1117 | 10.1021/ic980650s | 0.71073 | MoKα | 0.0834 | 0.0494 | null | null | 0.104 | 0.118 | null | null | null | null | null | 1.016 | null | null | has coordinates | Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro
Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes
Inorganic Chemistry
38
(1999)
1108-1117 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:18:08 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179321 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/4/32/18/4321823.cif $
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2,009,542 | 11.903 | 0.002 | 20.019 | 0.004 | 21.64 | 0.003 | 90 | null | 90 | null | 90 | null | 5,156.5 | 1.5 | 291 | null | null | null | null | null | null | null | 6 | P 21 21 21 | P 2ac 2ab | null | - C52 H51 F15 N P Pt - | - C52 H45 F15 N P Pt - | - C208 H180 F60 N4 P4 Pt4 - | 4 | 1 | HU1049 | Ara, I.; Milagros, T. | Tetra-<i>n</i>-butylammonium tris(perfluorophenyl)(triphenylphosphine)platinate(II) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 375 | 377 | 10.1107/S0108270193008649 | 0.71069 | MoKα | null | 0.0391 | null | null | 0.0411 | null | null | null | null | null | null | null | null | null | has coordinates | Ara, I.; Milagros, T.
Tetra-<i>n</i>-butylammonium tris(perfluorophenyl)(triphenylphosphine)platinate(II)
Acta Crystallographica Section C
50(3)
(1994)
375-377 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/95/2009542.cif $
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2,009,543 | 11.364 | 0.002 | 16.452 | 0.003 | 18.609 | 0.004 | 90 | null | 90 | null | 90 | null | 3,479.1 | 1.2 | 290 | null | null | null | null | null | null | null | 3 | P 21 21 21 | P 2ac 2ab | null | - C21 H20 N2 - | - C21 H20 N2 - | - C168 H160 N16 - | 8 | 2 | HU1054 | Alcock, N.W.; Blacker, N.C.; Errington, W.; Wallbridge, M.G.H. | <i>N</i>^1^,<i>N</i>^2^-Di(<i>p</i>-tolyl)benzamidine, C~21~H~20~N~2~ | Acta Crystallographica Section C | 1,994 | 50 | 3 | 456 | 458 | 10.1107/S0108270193009035 | 0.71073 | MoKα | null | 0.051 | null | null | 0.07 | null | null | null | null | 1.16 | 1.16 | null | null | null | has coordinates | Alcock, N.W.; Blacker, N.C.; Errington, W.; Wallbridge, M.G.H.
<i>N</i>^1^,<i>N</i>^2^-Di(<i>p</i>-tolyl)benzamidine, C~21~H~20~N~2~
Acta Crystallographica Section C
50(3)
(1994)
456-458 | 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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2,009,544 | 18.938 | 0.004 | 7.112 | 0.001 | 16.205 | 0.003 | 90 | null | 90.91 | 0.03 | 90 | null | 2,182.3 | 0.7 | 293 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C23 H20 Br N5 O2 - | - C23 H20 Br N5 O2 - | - C92 H80 Br4 N20 O8 - | 4 | 1 | KA1041 | Gł ówka, M.L.; Oł ubek, Z. | 2'-Bromo-4-[<i>N</i>-(2-cyanoethyl)-<i>N</i>-(2-phenylethyl)]amino-4'-nitroazobenzene | Acta Crystallographica Section C | 1,994 | 50 | 3 | 458 | 460 | 10.1107/S0108270193007954 | 1.54178 | CuKα | null | 0.063 | null | null | 0.082 | null | null | null | null | 1.5 | 1.5 | null | null | null | has coordinates | Gł ówka, M.L.; Oł ubek, Z.
2'-Bromo-4-[<i>N</i>-(2-cyanoethyl)-<i>N</i>-(2-phenylethyl)]amino-4'-nitroazobenzene
Acta Crystallographica Section C
50(3)
(1994)
458-460 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
#$Revision: 301791 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/95/2009544.cif $
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2,009,545 | 11.495 | 0.005 | 11.815 | 0.005 | 18.4 | 0.01 | 83.09 | 0.05 | 76.79 | 0.05 | 77 | 0.03 | 2,364 | 2 | 291 | null | null | null | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C33 H42 Ce N15 O24 - | - C33 Ce N15 O24 - | - C66 Ce2 N30 O48 - | 2 | 1 | LI1055 | Barberato, C.; Castellano, E.E.; Vicentini, G.; Isolani, P.C.; Lima, M.I.R. | Cerium(III) and neodymium(III) picrate complexes with tetramethylurea | Acta Crystallographica Section C | 1,994 | 50 | 3 | 351 | 354 | 10.1107/S0108270193008765 | 1.54056 | CuKα | null | 0.0703 | null | null | 0.0745 | null | null | null | null | 1.77 | 1.77 | null | null | null | has coordinates | Barberato, C.; Castellano, E.E.; Vicentini, G.; Isolani, P.C.; Lima, M.I.R.
Cerium(III) and neodymium(III) picrate complexes with tetramethylurea
Acta Crystallographica Section C
50(3)
(1994)
351-354 | 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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2,009,546 | 18.913 | 0.005 | 12.386 | 0.005 | 22.134 | 0.005 | 90 | null | 112.2 | 0.05 | 90 | null | 4,801 | 3 | 291 | null | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C33 H42 N15 Nd O24 - | - C33 N15 Nd O24 - | - C132 N60 Nd4 O96 - | 4 | 1 | LI1055 | Barberato, C.; Castellano, E.E.; Vicentini, G.; Isolani, P.C.; Lima, M.I.R. | Cerium(III) and neodymium(III) picrate complexes with tetramethylurea | Acta Crystallographica Section C | 1,994 | 50 | 3 | 351 | 354 | 10.1107/S0108270193008765 | 1.54056 | CuKα | null | 0.06 | null | null | 0.0642 | null | null | null | null | 1.44 | 1.44 | null | null | null | has coordinates | Barberato, C.; Castellano, E.E.; Vicentini, G.; Isolani, P.C.; Lima, M.I.R.
Cerium(III) and neodymium(III) picrate complexes with tetramethylurea
Acta Crystallographica Section C
50(3)
(1994)
351-354 | 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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4,321,822 | 14.2168 | 0.0014 | 14.354 | 0.0017 | 18.679 | 0.002 | 81.101 | 0.01 | 67.763 | 0.009 | 89.107 | 0.009 | 3,482 | 0.7 | 193 | 2 | 193 | 2 | null | null | null | null | 5 | P -1 | -P 1 | 2 | - C18 H15 Cd K O3 - | - C16.875 H27.75 Cd0.25 K0.25 O2.375 - | - C135 H222 Cd2 K2 O19 - | 8 | 4 | Donald J. Darensbourg; Sharon A. Niezgoda; Jennifer D. Draper; Joseph H. Reibenspies | trigonal-Planar Zinc(II) and Cadmium(II) Tris(phenoxide) Complexes | Inorganic Chemistry | 1,999 | 38 | 1356 | 1359 | 10.1021/ic9805325 | 0.71073 | MoKα | 0.093 | 0.0675 | null | null | 0.168 | 0.1791 | null | null | null | null | null | 1.381 | null | null | has coordinates | Donald J. Darensbourg; Sharon A. Niezgoda; Jennifer D. Draper; Joseph H. Reibenspies
trigonal-Planar Zinc(II) and Cadmium(II) Tris(phenoxide) Complexes
Inorganic Chemistry
38
(1999)
1356-1359 | 179,321 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-03-23 15:18:08 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179321 $
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2,009,547 | 9.2228 | 0.0008 | 11.7012 | 0.0008 | 9.8752 | 0.0009 | 90 | null | 90 | null | 90 | null | 1,065.71 | 0.15 | 293 | null | null | null | null | null | null | null | 5 | P n c 2 | P 2 -2bc | 30 | - C18 H28 Cd Cl2 N6 - | - C18 H28 Cd Cl2 N6 - | - C36 H56 Cd2 Cl4 N12 - | 2 | 0.5 | LI1057 | Castro, J.A.; Romero, J.; Garcia-Vazquez, J.A.; Macias, A.; Sousa, A.; Englert, U. | Dichloro[5,8-dimethyl-1,12-di-2-pyrrolyl-2,5,8,11-tetraaza-1,11-dodecadiene-<i>N</i>^2^,<i>N</i>^5^,<i>N</i>^8^,<i>N</i>^11^]cadmium(II) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 369 | 371 | 10.1107/S0108270193007577 | 1.5406 | CuKα | null | 0.042 | null | null | 0.049 | null | null | null | null | 1.15 | 1.15 | null | null | null | has coordinates | Castro, J.A.; Romero, J.; Garcia-Vazquez, J.A.; Macias, A.; Sousa, A.; Englert, U.
Dichloro[5,8-dimethyl-1,12-di-2-pyrrolyl-2,5,8,11-tetraaza-1,11-dodecadiene-<i>N</i>^2^,<i>N</i>^5^,<i>N</i>^8^,<i>N</i>^11^]cadmium(II)
Acta Crystallographica Section C
50(3)
(1994)
369-371 | 198,527 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2017-07-07 01:16:51 +0300 (Fri, 07 Jul 2017) $
#$Revision: 198527 $
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2,009,548 | 18.084 | 0.005 | 18.084 | 0.005 | 18.084 | 0.005 | 90 | null | 90 | null | 90 | null | 5,914 | 3 | 298 | null | null | null | null | null | null | null | 3 | F -4 3 m | F -4 2 3 | null | - Fe Ni Zn6.5 - | - Fe1.00364 Zn6.47273 - | - Fe55.2 Zn356 - | 55 | 0.572917 | MU1047 | Lidin, S.; Jacob, M.; Larsson, A.-K. | (Fe,Ni)Zn~6.5~, a superstructure of γ-brass | Acta Crystallographica Section C | 1,994 | 50 | 3 | 340 | 342 | 10.1107/S0108270193008650 | 0.71069 | MoKα | null | 0.041 | null | null | 0.057 | null | null | null | null | 1.3162 | 1.3162 | null | null | null | has coordinates | Lidin, S.; Jacob, M.; Larsson, A.-K.
(Fe,Ni)Zn~6.5~, a superstructure of γ-brass
Acta Crystallographica Section C
50(3)
(1994)
340-342 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/2/00/95/2009548.cif $
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2,009,549 | 13.516 | 0.007 | 13.516 | 0.007 | 10.353 | 0.005 | 90 | null | 90 | null | 90 | null | 1,891.3 | 1.7 | 296 | null | null | null | null | null | null | null | 5 | P 4/n :2 | -P 4a | 85 | - C12 H56 B4 P4 Zr2 - | - C12 H56 B4 P4 Zr2 - | - C24 H112 B8 P8 Zr4 - | 2 | 0.25 | MU1053 | Mayo, S.C.; Brown, M.; Lloyd, V.K. | A zirconium polyhydride dimer, [Zr~2~H~4~(BH~4~)~4~(PMe~3~)~4~] | Acta Crystallographica Section C | 1,994 | 50 | 3 | 367 | 369 | 10.1107/S0108270193008042 | 0.71073 | MoKα | null | 0.062 | null | null | 0.054 | null | null | null | null | 1.82 | 1.82 | null | null | null | has coordinates | Mayo, S.C.; Brown, M.; Lloyd, V.K.
A zirconium polyhydride dimer, [Zr~2~H~4~(BH~4~)~4~(PMe~3~)~4~]
Acta Crystallographica Section C
50(3)
(1994)
367-369 | 206,022 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
#$Date: 2018-02-01 14:52:20 +0200 (Thu, 01 Feb 2018) $
#$Revision: 206022 $
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2,009,550 | 9.3226 | 0.0006 | 14.301 | 0.001 | 15.042 | 0.001 | 90 | null | 90 | null | 90 | null | 2,005.4 | 0.2 | 293 | 1 | null | null | null | null | null | null | 5 | P 21 21 21 | P 2ac 2ab | null | - C16 H22 Cl N7 O6 - | - C16 H22 Cl N7 O6 - | - C64 H88 Cl4 N28 O24 - | 4 | 1 | MU1060 | Golič, L.; Sinur, A.; Stanovnik, B.; Žličar, M. | Two substituted pyrazolo[1',2':1,2]pyrazolo[4,3-<i>d</i>]tetrazolo[1,5-<i>b</i>]pyridazines | Acta Crystallographica Section C | 1,994 | 50 | 3 | 466 | 469 | 10.1107/S0108270193007838 | 0.71069 | MoKα | null | 0.032 | null | null | 0.04 | null | null | null | null | 0.584 | 0.584 | null | null | null | has coordinates | Golič, L.; Sinur, A.; Stanovnik, B.; Žličar, M.
Two substituted pyrazolo[1',2':1,2]pyrazolo[4,3-<i>d</i>]tetrazolo[1,5-<i>b</i>]pyridazines
Acta Crystallographica Section C
50(3)
(1994)
466-469 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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2,009,551 | 11.4371 | 0.0008 | 17.879 | 0.001 | 12.7762 | 0.0009 | 90 | null | 109.406 | 0.006 | 90 | null | 2,464.1 | 0.3 | 293 | 1 | null | null | null | null | null | null | 5 | P 1 21/c 1 | -P 2ybc | null | - C23 H21 Cl N8 O6 - | - C23 H21 Cl N8 O6 - | - C92 H84 Cl4 N32 O24 - | 4 | 1 | MU1060 | Golič, L.; Sinur, A.; Stanovnik, B.; Žličar, M. | Two substituted pyrazolo[1',2':1,2]pyrazolo[4,3-<i>d</i>]tetrazolo[1,5-<i>b</i>]pyridazines | Acta Crystallographica Section C | 1,994 | 50 | 3 | 466 | 469 | 10.1107/S0108270193007838 | 0.71069 | MoKα | null | 0.038 | null | null | 0.05 | null | null | null | null | 0.998 | 0.998 | null | null | null | has coordinates | Golič, L.; Sinur, A.; Stanovnik, B.; Žličar, M.
Two substituted pyrazolo[1',2':1,2]pyrazolo[4,3-<i>d</i>]tetrazolo[1,5-<i>b</i>]pyridazines
Acta Crystallographica Section C
50(3)
(1994)
466-469 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
#$Date: 2025-08-19 01:52:38 +0300 (Tue, 19 Aug 2025) $
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4,321,821 | 11.027 | 0.001 | 14.226 | 0.004 | 16.143 | 0.002 | 87.19 | 0.02 | 73.42 | 0.01 | 80.47 | 0.01 | 2,393.6 | 0.8 | 293 | 2 | 293 | 2 | null | null | null | null | synthesis | 7 | P -1 | -P 1 | 2 | \5-Cyclodiphosphazanes | - C40 H37 Br Cl8 N3 O7 P3 - | - C40 H37 Br Cl8 N3 O7 P3 - | - C80 H74 Br2 Cl16 N6 O14 P6 - | 2 | 1 | Natesan Thirupathi; Setharampattu S. Krishnamurthy; Munirathinam Nethaji | Oxidative Addition of Tetrachloro-1,2-benzoquinone to λ3-Cyclotriphosphazanes. An Unusual Ring Contraction-Rearrangement | Inorganic Chemistry | 1,999 | 38 | 1093 | 1098 | 10.1021/ic980459i | 0.71073 | MoKa | 0.1929 | 0.0784 | null | 0.1934 | 0.1369 | null | null | null | 1.13 | 1.243 | 1.243 | null | null | null | has coordinates | Natesan Thirupathi; Setharampattu S. Krishnamurthy; Munirathinam Nethaji
Oxidative Addition of Tetrachloro-1,2-benzoquinone to λ3-Cyclotriphosphazanes. An Unusual Ring Contraction-Rearrangement
Inorganic Chemistry
38
(1999)
1093-1098 | 301,838 | 2025-08-20 | 22:17:34 | #------------------------------------------------------------------------------
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2,009,552 | 9.157 | 0.001 | 12.264 | 0.001 | 18.163 | 0.002 | 90 | null | 90 | null | 90 | null | 2,039.7 | 0.4 | 292 | null | null | null | null | null | null | null | 4 | P 21 21 21 | P 2ac 2ab | null | - C24 H21 N3 O - | - C24 H21 N3 O - | - C96 H84 N12 O4 - | 4 | 1 | NA1035 | Bruno, G.; Nicolo, F.; Foti, F.; Grassi, G.; Risitano, F.; Munno, G.De. | Synthesis of <i>N</i>-benzoyl-1,3-imidazole oximes. Structure of C~24~H~21~N~3~O | Acta Crystallographica Section C | 1,994 | 50 | 3 | 428 | 430 | 10.1107/S0108270193007085 | 0.71073 | MoKα | null | 0.048 | null | null | 0.056 | null | null | null | null | 0.98 | 0.98 | null | null | null | has coordinates | Bruno, G.; Nicolo, F.; Foti, F.; Grassi, G.; Risitano, F.; Munno, G.De.
Synthesis of <i>N</i>-benzoyl-1,3-imidazole oximes. Structure of C~24~H~21~N~3~O
Acta Crystallographica Section C
50(3)
(1994)
428-430 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,553 | 5.984 | 0.002 | 11.703 | 0.004 | 12.559 | 0.004 | 90 | null | 99.11 | 0.02 | 90 | null | 868.4 | 0.5 | 297 | null | 297 | null | null | null | null | null | 4 | P 1 21/c 1 | -P 2ybc | 14 | Bicyclo(2.2.1)hepta-2,5-diene-2,3-dicarboxamide | - C9 H10 N2 O2 - | - C9 H10 N2 O2 - | - C36 H40 N8 O8 - | 4 | 1 | PA1037 | Gourdon, André; Lainé, Philippe | Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxamide, C~9~H~10~N~2~O~2~ | Acta Crystallographica Section C | 1,994 | 50 | 3 | 414 | 415 | 10.1107/S0108270193002021 | 0.71069 | MoKα | null | 0.04 | null | null | 0.039 | null | null | null | null | null | null | null | null | null | has coordinates | Gourdon, André; Lainé, Philippe
Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxamide, C~9~H~10~N~2~O~2~
Acta Crystallographica Section C
50(3)
(1994)
414-415 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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2,009,554 | 7.74 | 0.01 | 7.94 | 0.02 | 9.02 | 0.01 | 100.7 | 0.1 | 94.5 | 0.1 | 115.8 | 0.1 | 482.4 | 1.6 | 293 | 1 | null | null | null | null | null | null | 6 | P -1 | -P 1 | 2 | - C10 H24 Cl4 Cu N4 S2 - | - C10 H24 Cl4 Cu N4 S2 - | - C10 H24 Cl4 Cu N4 S2 - | 1 | 0.5 | PA1051 | Viossat, B.; Nguyen-Huy, Dung.; Lancelot, J.C. | Sels de <i>S</i>,<i>S</i>'-(alcane-α,ω-diyle)bis(thiouronium). I. Structure du tétrachlorocuprate(II) de <i>S</i>,<i>S</i>'-(octane-1,8-diyle)bis(thiouronium) | Acta Crystallographica Section C | 1,994 | 50 | 3 | 362 | 364 | 10.1107/S0108270193007395 | 0.7107 | MoKα | null | 0.041 | null | null | 0.046 | null | null | null | null | 3.4 | 3.4 | null | null | null | has coordinates | Viossat, B.; Nguyen-Huy, Dung.; Lancelot, J.C.
Sels de <i>S</i>,<i>S</i>'-(alcane-α,ω-diyle)bis(thiouronium). I. Structure du tétrachlorocuprate(II) de <i>S</i>,<i>S</i>'-(octane-1,8-diyle)bis(thiouronium)
Acta Crystallographica Section C
50(3)
(1994)
362-364 | 176,435 | 2020-10-21 | 18:00:00 | #------------------------------------------------------------------------------
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2,009,555 | 11.224 | 0.004 | 8.88 | 0.003 | 11.046 | 0.004 | 101.66 | 0.04 | 99.69 | 0.04 | 125.71 | 0.04 | 816.8 | 0.8 | 293 | null | 293 | null | null | null | null | null | 3 | P -1 | -P 1 | 2 | Ethyl (2E,4E,6E)-7-(6-methyl-2H-1-benzopyran-3-yl)hepta-2,4,6-trienoate nom chimique (2E,4E,6E)-7-(6-méthyl-2H-1-benzopyran-3-yl)hepta-2,4,6-triénoate d'éthyle | - C19 H20 O3 - | - C19 H20 O3 - | - C38 H40 O6 - | 2 | 1 | PA1072 | Leger, Jean Michel; Carpy, Alain; Belachmi, Larbi; Leblois, Daniéle; Le Baut, Guillaume | (2<i>E</i>,4<i>E</i>,6<i>E</i>)-7-(6-Méthyl-2<i>H</i>-1-benzopyran-3-yl)hepta-2,4,6-triénoate d'éthyle | Acta Crystallographica Section C | 1,994 | 50 | 3 | 419 | 421 | 10.1107/S0108270193010364 | 1.5418 | CuKα | null | 0.053 | null | null | 0.08 | null | null | null | null | 0.362 | 0.362 | null | null | null | has coordinates | Leger, Jean Michel; Carpy, Alain; Belachmi, Larbi; Leblois, Daniéle; Le Baut, Guillaume
(2<i>E</i>,4<i>E</i>,6<i>E</i>)-7-(6-Méthyl-2<i>H</i>-1-benzopyran-3-yl)hepta-2,4,6-triénoate d'éthyle
Acta Crystallographica Section C
50(3)
(1994)
419-421 | 301,791 | 2025-08-18 | 23:15:34 | #------------------------------------------------------------------------------
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