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Information card for entry 7046276
Preview
| Coordinates | 7046276.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C100 H168 B6 Mg2 N4 O12 |
|---|---|
| Calculated formula | C94 H154 B6 Mg2 N4 O12 |
| Title of publication | Diborane Heterolysis: Breaking and Making B-B bonds at Magnesium |
| Authors of publication | Hill, Michael; Mahon, Mary F.; Pecharman, Anne-Frederique |
| Journal of publication | Dalton Transactions |
| Year of publication | 2018 |
| a | 45.271 ± 0.003 Å |
| b | 18.2367 ± 0.0007 Å |
| c | 37.898 ± 0.002 Å |
| α | 90° |
| β | 122.981 ± 0.008° |
| γ | 90° |
| Cell volume | 26246 ± 3 Å3 |
| Cell temperature | 150.01 ± 0.1 K |
| Ambient diffraction temperature | 150.01 ± 0.1 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 | 0.1381 |
| Residual factor for significantly intense reflections | 0.0781 |
| Weighted residual factors for significantly intense reflections | 0.2155 |
| Weighted residual factors for all reflections included in the refinement | 0.2621 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.945 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207701 (current) | 2018-05-09 | cif/ Adding structures of 7046272, 7046273, 7046274, 7046275, 7046276, 7046277 via cif-deposit CGI script. |
7046276.cif |
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