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Information card for entry 7250771
Preview
| Coordinates | 7250771.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H20 N O |
|---|---|
| Calculated formula | C21 H20 N O |
| Title of publication | Effects of diphenyl-vinyl-substituted diketopyrrolopyrrole isomers on stacking and luminescence. |
| Authors of publication | Wang, Ruixin; Yang, Puxi; Chen, Huizhi; Lan, Songming; Li, Haoyu; Fan, Wei; Gao, Guangpeng; Li, Xiaofang |
| Journal of publication | RSC advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 29 |
| Pages of publication | 23681 - 23686 |
| a | 14.8338 ± 0.0007 Å |
| b | 8.9317 ± 0.0003 Å |
| c | 12.4283 ± 0.0005 Å |
| α | 90° |
| β | 98.816 ± 0.004° |
| γ | 90° |
| Cell volume | 1627.18 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0997 |
| Residual factor for significantly intense reflections | 0.0795 |
| Weighted residual factors for significantly intense reflections | 0.2265 |
| Weighted residual factors for all reflections included in the refinement | 0.2521 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.111 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301468 (current) | 2025-08-05 | cif/ Adding structures of 7250769, 7250770, 7250771 via cif-deposit CGI script. |
7250771.cif |
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Users of the data should acknowledge the original authors of the
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