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Information card for entry 7236813
Preview
| Coordinates | 7236813.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C22 H20 N2 |
|---|---|
| Calculated formula | C22 H20 N2 |
| Title of publication | Luminescence-/morphology-modulation of organic microcrystals by a protonation process |
| Authors of publication | Li, Zhi-Zhou; Wang, Xue-Dong; Liao, Liang-Sheng |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2017 |
| Journal volume | 5 |
| Journal issue | 27 |
| Pages of publication | 6661 |
| a | 11.152 ± 0.002 Å |
| b | 9.6889 ± 0.0019 Å |
| c | 30.579 ± 0.006 Å |
| α | 90° |
| β | 97.11 ± 0.03° |
| γ | 90° |
| Cell volume | 3278.7 ± 1.1 Å3 |
| Cell temperature | 173.15 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 3 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.1216 |
| Residual factor for significantly intense reflections | 0.0977 |
| Weighted residual factors for significantly intense reflections | 0.2233 |
| Weighted residual factors for all reflections included in the refinement | 0.2441 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
| 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. |
7236813.cif |
| 236535 | 2019-11-24 | cif/ Adding structures of 7236813 via cif-deposit CGI script. |
7236813.cif |
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Users of the data should acknowledge the original authors of the
structural data.