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Information card for entry 7232914
Preview
| Coordinates | 7232914.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H20 N4 O3 |
|---|---|
| Calculated formula | C20 H20 N4 O3 |
| Title of publication | Colour-tunable ultralong organic phosphorescence upon temperature stimulus |
| Authors of publication | Niu, Zuoji; Ma, Chaoqun; Ye, Wenpeng; Wang, He; Jia, Wenyong; Shi, Huixian; Shi, Huifang; An, Zhongfu; Huang, Wei |
| Journal of publication | RSC Advances |
| Year of publication | 2019 |
| Journal volume | 9 |
| Journal issue | 33 |
| Pages of publication | 19075 |
| a | 12.9566 ± 0.0014 Å |
| b | 10.8698 ± 0.0012 Å |
| c | 12.9109 ± 0.0014 Å |
| α | 90° |
| β | 101.36 ± 0.003° |
| γ | 90° |
| Cell volume | 1782.7 ± 0.3 Å3 |
| Cell temperature | 99.99 K |
| Ambient diffraction temperature | 99.99 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 | 0.0836 |
| Residual factor for significantly intense reflections | 0.0568 |
| Weighted residual factors for significantly intense reflections | 0.1356 |
| Weighted residual factors for all reflections included in the refinement | 0.1502 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| 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. |
7232914.cif |
| 216049 | 2019-06-18 | cif/ Adding structures of 7232913, 7232914 via cif-deposit CGI script. |
7232914.cif |
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Users of the data should acknowledge the original authors of the
structural data.