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Information card for entry 7132549
Preview
| Coordinates | 7132549.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H14 N O P S |
|---|---|
| Calculated formula | C19 H14 N O P S |
| SMILES | P(=O)(c1ccccc1)(c1ccccc1)c1sc2c(n1)cccc2 |
| Title of publication | Carbazole-based artificial light-harvesting system for photocatalytic cross-coupling dehydrogenation reaction. |
| Authors of publication | Sun, Guangping; Li, Menghang; Cai, Lijuan; Zhu, Jinli; Tang, Yanfeng; Yao, Yong |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2024 |
| Journal volume | 60 |
| Journal issue | 11 |
| Pages of publication | 1412 - 1415 |
| a | 8.385 ± 0.002 Å |
| b | 10.473 ± 0.003 Å |
| c | 10.511 ± 0.003 Å |
| α | 109.339 ± 0.003° |
| β | 92.044 ± 0.003° |
| γ | 102.717 ± 0.003° |
| Cell volume | 843.7 ± 0.4 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0396 |
| Residual factor for significantly intense reflections | 0.0363 |
| Weighted residual factors for significantly intense reflections | 0.0929 |
| Weighted residual factors for all reflections included in the refinement | 0.097 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289388 (current) | 2024-02-04 | cif/ Updating files of 7132549 Original log message: Adding full bibliography for 7132549.cif. |
7132549.cif |
| 288576 | 2024-01-01 | cif/ Adding structures of 7132549 via cif-deposit CGI script. |
7132549.cif |
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Users of the data should acknowledge the original authors of the
structural data.