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Information card for entry 8106276
Preview
| Coordinates | 8106276.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H18 N2 |
|---|---|
| Calculated formula | C28 H18 N2 |
| Title of publication | Crystal structure of 1,1-di(4-cyanophenyl)-2,2-diphenylethene, C28H18N2 |
| Authors of publication | Bao-Xi, Miao; Hao, Sun; Zhong-Hai, Ni |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2018 |
| Journal volume | 233 |
| Journal issue | 4 |
| Pages of publication | 727 - 729 |
| a | 9.8955 ± 0.0006 Å |
| b | 11.0163 ± 0.0006 Å |
| c | 19.9752 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2177.5 ± 0.2 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.0482 |
| Residual factor for significantly intense reflections | 0.0402 |
| Weighted residual factors for significantly intense reflections | 0.0968 |
| Weighted residual factors for all reflections included in the refinement | 0.1012 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279597 (current) | 2022-11-28 | cif/ Adding structures of 8106276 via cif-deposit CGI script. |
8106276.cif |
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Users of the data should acknowledge the original authors of the
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