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CIF Information Card
Information card for 2000025
2000024 << 2000025 >> 2000026Preview
|
Coordinates |
2000025.cif |
Structure parameters
| Formula | - C122 H230 P6 S8 W6 - |
| Calculated formula | - C122 H230 P6 S8 W6 - |
| Title of publication | Ligand Substitution Reactions of W6S8L6 with Tricyclohexylphosphine (L = 4-tert-Butylpyridine or n-Butylamine): 31P NMR and Structural Studies of W6S8(PCy3)n(4-tert-butylpyridine)6-n (0 < n <= 6) Complexes |
| Authors of publication | Song Jin; D. Venkataraman; Francis J. DiSalvo |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2000 |
| Journal volume | 39 |
| Pages of publication | 2747 - 2757 |
| a | 15.0729 ± 0.0001 Å |
| b | 15.2558 ± 0.0001 Å |
| c | 16.0623 ± 0.0002 Å |
| α | 62.161 ± 0.001° |
| β | 78.813 ± 0.001° |
| γ | 73.48° |
| Cell volume | 3123.04 Å3 |
| Ambient diffraction temperature | 165 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Residual factor for all reflections | 0.0752 |
| Residual factor for observed reflections | 0.046 |
| Weighted residual factors for all reflections | 0.1443 |
| Weighted residual factors for the observed reflections | 0.046 |
| Goodness-of-fit parameter for all reflections | 0.946 |
| Goodness-of-fit parameter for observed reflections | 0.976 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |