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Information card for entry 7702851
Preview
| Coordinates | 7702851.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H18 B Br Fe O2 |
|---|---|
| Calculated formula | C17 H18 B Br Fe O2 |
| Title of publication | Synthetic, structural and reaction chemistry of transition metal complexes containing the mesitylborylene ligand |
| Authors of publication | Coombs, Deborah L.; Aldridge, Simon; Jones, Cameron |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 20 |
| Pages of publication | 3851 |
| a | 8.315 ± 0.0017 Å |
| b | 15.283 ± 0.003 Å |
| c | 14.113 ± 0.003 Å |
| α | 90° |
| β | 104.89 ± 0.03° |
| γ | 90° |
| Cell volume | 1733.2 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0555 |
| Residual factor for significantly intense reflections | 0.0448 |
| Weighted residual factors for significantly intense reflections | 0.0923 |
| Weighted residual factors for all reflections included in the refinement | 0.0974 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244049 (current) | 2019-11-28 | cif/ Adding structures of 7702846, 7702847, 7702848, 7702849, 7702850, 7702851, 7702852 via cif-deposit CGI script. |
7702851.cif |
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Users of the data should acknowledge the original authors of the
structural data.