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Information card for entry 7125113
Preview
| Coordinates | 7125113.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H62 B K N O7 |
|---|---|
| Calculated formula | C41 H62 B K N O7 |
| Title of publication | A boron-centered radical: a potassium-crown ether stabilized boryl radical anion. |
| Authors of publication | Yuan, Ningning; Wang, Wenqing; Wu, Ziye; Chen, Sheng; Tan, Gengwen; Sui, Yunxia; Wang, Xinping; Jiang, Jun; Power, Philip P. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2016 |
| Journal volume | 52 |
| Journal issue | 86 |
| Pages of publication | 12714 - 12716 |
| a | 8.243 ± 0.0007 Å |
| b | 20.22 ± 0.0018 Å |
| c | 12.5726 ± 0.0012 Å |
| α | 90° |
| β | 101.097 ± 0.003° |
| γ | 90° |
| Cell volume | 2056.3 ± 0.3 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0353 |
| Residual factor for significantly intense reflections | 0.0337 |
| Weighted residual factors for significantly intense reflections | 0.0861 |
| Weighted residual factors for all reflections included in the refinement | 0.087 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 234525 (current) | 2019-11-23 | cif/ Adding structures of 7125112, 7125113 via cif-deposit CGI script. |
7125113.cif |
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Users of the data should acknowledge the original authors of the
structural data.