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Information card for entry 1553079
Preview
| Coordinates | 1553079.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H46 Br2 Co N3 O4 |
|---|---|
| Calculated formula | C32 H44 Br2 Co N3 O4 |
| Title of publication | Efficient C-H Bond Activations <i>via</i> O<sub>2</sub> Cleavage by a Dianionic Cobalt(II) Complex. |
| Authors of publication | Nguyen, Andy I.; Hadt, Ryan G.; Solomon, Edward I.; Tilley, T. Don |
| Journal of publication | Chemical science |
| Year of publication | 2014 |
| Journal volume | 5 |
| Journal issue | 7 |
| Pages of publication | 2874 - 2878 |
| a | 18.491 ± 0.0011 Å |
| b | 8.1781 ± 0.0004 Å |
| c | 21.8017 ± 0.0013 Å |
| α | 90° |
| β | 93.873 ± 0.003° |
| γ | 90° |
| Cell volume | 3289.4 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/n 1 |
| Hall space group symbol | -P 2yac |
| Residual factor for all reflections | 0.0515 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.0702 |
| Weighted residual factors for all reflections included in the refinement | 0.0767 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233271 (current) | 2019-11-23 | cif/ Adding structures of 1553077, 1553078, 1553079, 1553080 via cif-deposit CGI script. |
1553079.cif |
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Users of the data should acknowledge the original authors of the
structural data.