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Information card for entry 7064430
Preview
| Coordinates | 7064430.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H20 N2 O |
|---|---|
| Calculated formula | C31 H20 N2 O |
| Title of publication | D–π–A type AIE molecules exhibiting persistent room temperature phosphorescence and delayed fluorescence through structural regulation |
| Authors of publication | Zhang, Zhihua; Qu, Hongmei; Li, Xia; Li, Yameng; Dai, Ruihan; Zhang, Xuesong; Pan, Wenjing |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2026 |
| Journal volume | 50 |
| Journal issue | 20 |
| Pages of publication | 8823 - 8834 |
| a | 18.7211 ± 0.0006 Å |
| b | 9.7293 ± 0.0003 Å |
| c | 11.9442 ± 0.0004 Å |
| α | 90° |
| β | 94.533 ± 0.001° |
| γ | 90° |
| Cell volume | 2168.75 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0412 |
| Residual factor for significantly intense reflections | 0.0408 |
| Weighted residual factors for significantly intense reflections | 0.1005 |
| Weighted residual factors for all reflections included in the refinement | 0.1008 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306234 (current) | 2026-06-05 | cif/ Adding structures of 7064429, 7064430, 7064431 via cif-deposit CGI script. |
7064430.cif |
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Users of the data should acknowledge the original authors of the
structural data.