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Information card for entry 1562853
Preview
| Coordinates | 1562853.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C79 H56 B F24 O P2 Rh |
|---|---|
| Calculated formula | C79 H56 B F24 O P2 Rh |
| Title of publication | Ortho-aryl substituted DPEphos ligands: Rhodium Complexes Featuring C‒H Anagostic Interactions and B‒H Agostic Bonds. |
| Authors of publication | Race, James; Burnage, Arron; Boyd, Timothy M.; Heyam, Alex; Martinez-Martinez, Antonio J.; Macgregor, Stuart Alan; Weller, Andrew S. |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 13.1702 ± 0.0002 Å |
| b | 15.7363 ± 0.0003 Å |
| c | 17.8817 ± 0.0003 Å |
| α | 81.607 ± 0.002° |
| β | 84.675 ± 0.001° |
| γ | 84.508 ± 0.001° |
| Cell volume | 3637.75 ± 0.11 Å3 |
| Cell temperature | 150.01 ± 0.1 K |
| Ambient diffraction temperature | 150.15 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0438 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.1129 |
| Weighted residual factors for all reflections included in the refinement | 0.1146 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265490 (current) | 2021-05-26 | cif/ Adding structures of 1562851, 1562852, 1562853, 1562854, 1562855, 1562856, 1562857 via cif-deposit CGI script. |
1562853.cif |
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Users of the data should acknowledge the original authors of the
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