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Information card for entry 7233602
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| Coordinates | 7233602.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H24 S2 |
|---|---|
| Calculated formula | C38 H24 S2 |
| Title of publication | Rubrene analogues with the aggregation-induced emission enhancement behaviour |
| Authors of publication | Xiaotao Zhang; Jakob K. Sorensen; Xiaolong Fu; Yonggang Zhen; Guangyao Zhao; Lang Jiang; Huanli Dong; Jie Liu; Zhigang Shuai; Hua Geng; Thomas Bjornholm; Wenping Hu |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2014 |
| Journal volume | 2 |
| Pages of publication | 884 - 890 |
| a | 10.173 ± 0.002 Å |
| b | 8.9148 ± 0.0018 Å |
| c | 14.751 ± 0.003 Å |
| α | 90° |
| β | 95.17 ± 0.03° |
| γ | 90° |
| Cell volume | 1332.3 ± 0.5 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0712 |
| Residual factor for significantly intense reflections | 0.0649 |
| Weighted residual factors for significantly intense reflections | 0.1292 |
| Weighted residual factors for all reflections included in the refinement | 0.1326 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.173 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217910 (current) | 2019-09-02 | cif/ Adding structures of 7233602 via cif-deposit CGI script. |
7233602.cif |
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Users of the data should acknowledge the original authors of the
structural data.