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CIF Information Card
Information card for 7052603
7052602 << 7052603 >> 7052604Preview
|
Coordinates |
7052603.cif |
Structure parameters
| Formula | - C126 H123 Cl12 Fe11 N0 O42 - |
| Calculated formula | - C126 H117 Cl12 Fe11 O42 - |
| Title of publication | Hexanuclear Fe(iii) complexes and their thermal decomposition into an undecanuclear species |
| Authors of publication | Sañudo, E. C.; Font-Bardia, M.; Solans, X.; Laye, R. H. |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2011 |
| Journal volume | 35 |
| Journal issue | 4 |
| Pages of publication | 842 |
| a | 27.8503 ± 0.0009 Å |
| b | 27.8503 ± 0.0009 Å |
| c | 31.8394 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 21387.3 ± 1.3 Å3 |
| Cell temperature | 296 ± 0.1 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | R -3 :H |
| Hall symmetry space group | -R 3 |
| Residual factor for all reflections | 0.1083 |
| Residual factor for observed reflections | 0.074 |
| Weighted residual factors for the observed reflections | 0.1912 |
| Weighted residual factors for all reflections included in the refinement | 0.2324 |
| Goodness-of-fit parameter for observed reflections | 1.071 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |