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Information card for entry 7249706
Preview
| Coordinates | 7249706.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C88 H80 N4 O12 S4 |
|---|---|
| Calculated formula | C88 H80 N4 O12 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 | 13.2402 ± 0.0004 Å |
| b | 39.0334 ± 0.0013 Å |
| c | 19.5745 ± 0.0006 Å |
| α | 90° |
| β | 106.403 ± 0.003° |
| γ | 90° |
| Cell volume | 9704.6 ± 0.5 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.247 |
| Residual factor for significantly intense reflections | 0.2048 |
| Weighted residual factors for significantly intense reflections | 0.4046 |
| Weighted residual factors for all reflections included in the refinement | 0.424 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 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. |
7249706.cif |
| 296898 | 2024-12-18 | cif/ Adding structures of 7249703, 7249704, 7249705, 7249706 via cif-deposit CGI script. |
7249706.cif |
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Users of the data should acknowledge the original authors of the
structural data.