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Information card for entry 7112058
Preview
| Coordinates | 7112058.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H67 Fe2 Mo2 N37 O9 |
|---|---|
| Calculated formula | C62 H43 Fe2 Mo2 N37 O9 |
| Title of publication | Photo- and thermo-induced spin crossover in a cyanide-bridged {Mo^V^~2Fe^II^~2~} rhombus molecule |
| Authors of publication | A. Mondal; Y. Li; L.-M. Chamoreau; M. Seuleiman; L. Rechignat; A. Bousseksou; M.-L. Boillot; R. Lescouēzec |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 2893 |
| a | 13.0803 ± 0.0004 Å |
| b | 17.4938 ± 0.0006 Å |
| c | 17.6157 ± 0.0005 Å |
| α | 90° |
| β | 95.16 ± 0.002° |
| γ | 90° |
| Cell volume | 4014.6 ± 0.2 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0875 |
| Residual factor for significantly intense reflections | 0.0516 |
| Weighted residual factors for significantly intense reflections | 0.1371 |
| Weighted residual factors for all reflections included in the refinement | 0.1587 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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