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Information card for entry 7108858
Preview
| Coordinates | 7108858.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C184 H162 B8 F32 Fe4 N62 O12 |
|---|---|
| Calculated formula | C184 H162 B8 F32 Fe4 N62 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 | 46.2462 ± 0.0008 Å |
| b | 15.5937 ± 0.0003 Å |
| c | 37.854 ± 0.003 Å |
| α | 90° |
| β | 123.814 ± 0.009° |
| γ | 90° |
| Cell volume | 22681 ± 3 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 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 | 0.1571 |
| Residual factor for significantly intense reflections | 0.1416 |
| Weighted residual factors for significantly intense reflections | 0.4086 |
| Weighted residual factors for all reflections included in the refinement | 0.4335 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.6 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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