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Information card for entry 1569279
Preview
| Coordinates | 1569279.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H28 |
|---|---|
| Calculated formula | C42 H28 |
| SMILES | c12ccccc1c(c1ccccc1c2c1ccccc1)c1ccccc1.c1cc2cccc3c2c2c(cc3)cccc12 |
| Title of publication | Additive-Assisted Crystallization of 9,10-Diphenylanthracene |
| Authors of publication | Sonina, Alina A.; Cheshkina, Darya S.; Kazantsev, Maxim S. |
| Journal of publication | Crystals |
| Year of publication | 2023 |
| Journal volume | 13 |
| Journal issue | 6 |
| Pages of publication | 861 |
| a | 16.4311 ± 0.001 Å |
| b | 8.03 ± 0.0003 Å |
| c | 11.2057 ± 0.0007 Å |
| α | 90° |
| β | 104.651 ± 0.002° |
| γ | 90° |
| Cell volume | 1430.43 ± 0.14 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 2 |
| 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 | 0.083 |
| Residual factor for significantly intense reflections | 0.0506 |
| Weighted residual factors for significantly intense reflections | 0.1181 |
| Weighted residual factors for all reflections included in the refinement | 0.1434 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284352 (current) | 2023-06-05 | cif/ Adding structures of 1569279 via cif-deposit CGI script. |
1569279.cif |
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