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Information card for entry 7234173
Preview
| Coordinates | 7234173.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C27 H18 N4 S |
|---|---|
| Calculated formula | C27 H18 N4 S |
| Title of publication | Side chain effects on the solid-state emission behaviours and mechano-fluorochromic activities of 10H-phenothiazinylbenzo[d]imidazoles |
| Authors of publication | Jiang, Hao; Liu, Xiao-Jing; Jia, Ran-Rong; Xu, Tian-Hui; Xia, Min |
| Journal of publication | RSC Advances |
| Year of publication | 2019 |
| Journal volume | 9 |
| Journal issue | 52 |
| Pages of publication | 30381 |
| a | 7.9212 ± 0.0003 Å |
| b | 9.5348 ± 0.0003 Å |
| c | 14.0962 ± 0.0005 Å |
| α | 88.056 ± 0.001° |
| β | 89.137 ± 0.001° |
| γ | 84.091 ± 0.001° |
| Cell volume | 1058.31 ± 0.06 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170.01 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 | 0.0638 |
| Residual factor for significantly intense reflections | 0.0466 |
| Weighted residual factors for significantly intense reflections | 0.1206 |
| Weighted residual factors for all reflections included in the refinement | 0.1342 |
| 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 |
|---|---|---|---|
| 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. |
7234173.cif |
| 218864 | 2019-09-26 | cif/ Adding structures of 7234173, 7234174, 7234175, 7234176, 7234177, 7234178, 7234179 via cif-deposit CGI script. |
7234173.cif |
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Users of the data should acknowledge the original authors of the
structural data.