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Information card for entry 7225343
Preview
| Coordinates | 7225343.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H17 O P |
|---|---|
| Calculated formula | C20 H17 O P |
| SMILES | P(c1ccc(C(=O)C)cc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Enhanced room-temperature phosphorescence of triphenylphosphine derivatives without metal and heavy atoms in their crystal phase |
| Authors of publication | Xue, Pengchong; Wang, Panpan; Chen, Peng; Ding, Jipeng; Lu, Ran |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| Journal volume | 6 |
| Journal issue | 57 |
| Pages of publication | 51683 |
| a | 8.5525 ± 0.0014 Å |
| b | 10.3525 ± 0.0017 Å |
| c | 10.5874 ± 0.0017 Å |
| α | 114.517 ± 0.016° |
| β | 99.585 ± 0.014° |
| γ | 90.156 ± 0.013° |
| Cell volume | 838.3 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 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 | 0.072 |
| Residual factor for significantly intense reflections | 0.0516 |
| Weighted residual factors for significantly intense reflections | 0.1302 |
| Weighted residual factors for all reflections included in the refinement | 0.146 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301865 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure. |
7225343.cif |
| 183095 | 2016-05-27 | cif/ Adding structures of 7225342, 7225343 via cif-deposit CGI script. |
7225343.cif |
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Users of the data should acknowledge the original authors of the
structural data.