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Information card for entry 7108859
Preview
| Coordinates | 7108859.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C144 H107 B8 F32 Fe4 N48 O12 |
|---|---|
| Calculated formula | C144 H107 B8 F32 Fe4 N48 O12 |
| Title of publication | A face-capped [Fe~4~L~4~]^8+^ spin crossover tetrahedral cage. |
| Authors of publication | Ferguson, Alan; Squire, Marie A.; Siretanu, Diana; Mitcov, Dmitri; Mathonière, Corine; Clérac, Rodolphe; Kruger, Paul E. |
| Journal of publication | Chemical Communications (Cambridge, United Kingdom) |
| Year of publication | 2013 |
| Journal volume | 49 |
| Journal issue | 16 |
| Pages of publication | 1597 - 1599 |
| a | 46.627 ± 0.007 Å |
| b | 15.8882 ± 0.0013 Å |
| c | 40.415 ± 0.005 Å |
| α | 90° |
| β | 127.15 ± 0.02° |
| γ | 90° |
| Cell volume | 23864 ± 8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.2379 |
| Residual factor for significantly intense reflections | 0.127 |
| Weighted residual factors for significantly intense reflections | 0.3073 |
| Weighted residual factors for all reflections included in the refinement | 0.3563 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.919 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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