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Information card for entry 7123765
Preview
| Coordinates | 7123765.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53 H68 B Mg N2 O3 P |
|---|---|
| Calculated formula | C53 H68 B Mg N2 O3 P |
| Title of publication | Diborane Heterolysis and P(V) Reduction by Ph3P=O Coordination to Magnesium |
| Authors of publication | Hill, Michael; Mahon, Mary F.; Pecharman, Anne-Frederique; McMullin, Claire; Rajabi, Nasir A. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 35.0861 ± 0.0006 Å |
| b | 13.1244 ± 0.0002 Å |
| c | 22.2626 ± 0.0004 Å |
| α | 90° |
| β | 100.785 ± 0.002° |
| γ | 90° |
| Cell volume | 10070.5 ± 0.3 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0951 |
| Residual factor for significantly intense reflections | 0.0856 |
| Weighted residual factors for significantly intense reflections | 0.1973 |
| Weighted residual factors for all reflections included in the refinement | 0.2025 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216748 (current) | 2019-07-05 | cif/ Adding structures of 7123765, 7123766 via cif-deposit CGI script. |
7123765.cif |
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Users of the data should acknowledge the original authors of the
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