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Information card for entry 7112121
Preview
| Coordinates | 7112121.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48.75 H35.5 Cl2.5 N6 Rh |
|---|---|
| Calculated formula | C48.753 H35.506 Cl2.506 N6 Rh |
| Title of publication | Springloaded porphyrin NHC hybrid rhodium(III) complexes: carbene dissociation and oxidation catalysis |
| Authors of publication | Juan Olguin; Helge Muller-Bunz; Martin Albrecht |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 3488 |
| a | 9.6618 ± 0.0001 Å |
| b | 17.3989 ± 0.0002 Å |
| c | 25.1987 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4236.02 ± 0.08 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0363 |
| Residual factor for significantly intense reflections | 0.0323 |
| Weighted residual factors for significantly intense reflections | 0.0801 |
| Weighted residual factors for all reflections included in the refinement | 0.0829 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| 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.