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Information card for entry 7112062
Preview
| Coordinates | 7112062.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | MP0229 |
|---|---|
| Formula | C44 H37 Cl Hf N4 O |
| Calculated formula | C44 H37 Cl1.005 Hf N4 O |
| Title of publication | Synthesis, structure and reactivity of group 4 corrole complexes |
| Authors of publication | Rosa Padilla; Heather L. Buckley; Ashleigh L. Ward; John Arnold |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 2922 |
| a | 30.972 ± 0.003 Å |
| b | 15.6087 ± 0.0011 Å |
| c | 18.9592 ± 0.0013 Å |
| α | 90° |
| β | 93.149 ± 0.004° |
| γ | 90° |
| Cell volume | 9151.7 ± 1.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0685 |
| Residual factor for significantly intense reflections | 0.0436 |
| Weighted residual factors for significantly intense reflections | 0.0995 |
| Weighted residual factors for all reflections included in the refinement | 0.1067 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.