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CIF Information Card
Information card for 1100965
1100964 << 1100965 >> 1100966Preview
|
Coordinates |
1100965.cif |
Structure parameters
| Formula | - C50 H40 Cu2 N2 P2 S4 W - |
| Calculated formula | - C50 H40 Cu2 N2 P2 S4 W - |
| Title of publication | Acetic Acid Induced Self-Assembly of Supramolecular Compounds [Et4N]3[(WS4Cu2)2(μ-CN)3].2MeCN and [PPh4][WS4Cu3(μ-CN)2].MeCN from Preformed Clusters [A]2[WS4(CuCN)2] (A = Et4N, PPh4) |
| Authors of publication | Jian-Ping Lang; Chang-Mei Jiao; Shan-Bao Qiao; Wen-Hua Zhang; Brendan F. Abrahams |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3664 - 3668 |
| a | 12.7724 ± 0.0004 Å |
| b | 14.3104 ± 0.0007 Å |
| c | 15.4164 ± 0.0006 Å |
| α | 70.926 ± 0.013° |
| β | 65.352 ± 0.011° |
| γ | 88.35 ± 0.02° |
| Cell volume | 2401.4 ± 0.4 Å3 |
| Cell temperature | 193.1 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for observed reflections | 0.055 |
| Weighted residual factors for all reflections included in the refinement | 0.07 |
| Goodness-of-fit parameter for observed reflections | 1.054 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |