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Information card for entry 7249703
Preview
| Coordinates | 7249703.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C78 H100 N4 O28 S4 |
|---|---|
| Calculated formula | C78 H100 N4 O28 S4 |
| Title of publication | Tetraphenylethylene-based blue light-emitting organic salt crystals |
| Authors of publication | Hu, Huifen; Yan, Yukun; Yang, Chengling; Wang, Wei |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| Journal volume | 27 |
| Journal issue | 5 |
| Pages of publication | 625 - 633 |
| a | 13.6216 ± 0.0006 Å |
| b | 17.3077 ± 0.0007 Å |
| c | 18.5961 ± 0.0008 Å |
| α | 81.85 ± 0.002° |
| β | 77.726 ± 0.002° |
| γ | 73.94 ± 0.002° |
| Cell volume | 4100.7 ± 0.3 Å3 |
| Cell temperature | 193 K |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0802 |
| Residual factor for significantly intense reflections | 0.0672 |
| Weighted residual factors for significantly intense reflections | 0.2231 |
| Weighted residual factors for all reflections included in the refinement | 0.2354 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298184 (current) | 2025-03-04 | cif/ Updating files of 7249703, 7249704, 7249705, 7249706 Original log message: Adding full bibliography for 7249703--7249706.cif. |
7249703.cif |
| 296898 | 2024-12-18 | cif/ Adding structures of 7249703, 7249704, 7249705, 7249706 via cif-deposit CGI script. |
7249703.cif |
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Users of the data should acknowledge the original authors of the
structural data.