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Information card for entry 4308759
Preview
| Coordinates | 4308759.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35 H29.5 Br6 Mo3 N0.5 P S15 |
|---|---|
| Calculated formula | C35 H28 Br6 Mo3 N0.5 P S15 |
| Title of publication | Synthesis, Crystal Structure, and Properties of Multicomponent Bis(ethylenedithio)tetrathiafulvalene Charge-Transfer Salts of the [Mo3S7Br6]2- Cluster |
| Authors of publication | Rosa Llusar; Sonia Triguero; Santiago Uriel; Cristian Vicent; Eugenio Coronado; Carlos J. Gomez-Garcia |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 1563 - 1570 |
| a | 12.467 ± 0.005 Å |
| b | 13.553 ± 0.006 Å |
| c | 18.193 ± 0.008 Å |
| α | 85.378 ± 0.011° |
| β | 78.576 ± 0.011° |
| γ | 65.858 ± 0.009° |
| Cell volume | 2750 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1912 |
| Residual factor for significantly intense reflections | 0.0996 |
| Weighted residual factors for significantly intense reflections | 0.2238 |
| Weighted residual factors for all reflections included in the refinement | 0.2805 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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