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Information card for entry 7238014
Preview
| Coordinates | 7238014.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C30 H25 N O2 |
|---|---|
| Calculated formula | C30 H25 N O2 |
| Title of publication | Utilizing the heterocyclic effect towards high contrast ratios of mechanoresponsive luminescence based on aromatic aldehydes |
| Authors of publication | Zhang, Fang; Liang, Xiaozhong; Li, Da; Yin, Xiangkai; Tian, Xia; Li, Bin; Xu, Hong; Guo, Kunpeng; Li, Jie |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2019 |
| Journal volume | 7 |
| Journal issue | 39 |
| Pages of publication | 12328 |
| a | 10.8799 ± 0.0007 Å |
| b | 13.3532 ± 0.0008 Å |
| c | 17.0824 ± 0.001 Å |
| α | 101.465 ± 0.005° |
| β | 97.263 ± 0.005° |
| γ | 109.371 ± 0.006° |
| Cell volume | 2244.3 ± 0.3 Å3 |
| Cell temperature | 173 ± 0.1 K |
| Ambient diffraction temperature | 173 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1014 |
| Residual factor for significantly intense reflections | 0.0603 |
| Weighted residual factors for significantly intense reflections | 0.1315 |
| Weighted residual factors for all reflections included in the refinement | 0.1608 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7238014.cif |
| 238837 | 2019-11-24 | cif/ Adding structures of 7238014, 7238015, 7238016 via cif-deposit CGI script. |
7238014.cif |
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Users of the data should acknowledge the original authors of the
structural data.