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CIF Information Card
Information card for 1100967
1100966 << 1100967 >> 1100968Preview
|
Coordinates |
1100967.cif |
Structure parameters
| Formula | - C56 H46 Cu6 N6 P2 S8 W2 - |
| Calculated formula | - C55.96 H16 Cu6 N6 P2 S8 W2 - |
| 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 | 30.344 ± 0.003 Å |
| b | 10.3195 ± 0.0007 Å |
| c | 26.17 ± 0.003 Å |
| α | 90° |
| β | 128.202 ± 0.003° |
| γ | 90° |
| Cell volume | 6439.7 ± 1.1 Å3 |
| Cell temperature | 193.1 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | C 1 2/c 1 |
| Hall symmetry space group | -C 2yc |
| Residual factor for observed reflections | 0.047 |
| Weighted residual factors for all reflections included in the refinement | 0.057 |
| Goodness-of-fit parameter for observed reflections | 1.012 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |