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Information card for entry 1576974
Preview
| Coordinates | 1576974.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H18 S |
|---|---|
| Calculated formula | C30 H18 S |
| Title of publication | Photochemical skeletal editing: one-step transformation of diaryl dithiophenes into regiodefined helicenes. |
| Authors of publication | Shi, Xiaoli; Mei, Ling; Dong, Chenxi; Zhao, Chunmei; Chen, Chen; Xu, Yimin; Xu, Wan; Li, Chunli; Wang, Guangxia; Ma, Zhiying; Wang, Hua |
| Journal of publication | Chemical science |
| Year of publication | 2026 |
| Journal volume | 17 |
| Journal issue | 20 |
| Pages of publication | 10082 - 10091 |
| a | 6.5519 ± 0.0002 Å |
| b | 11.8227 ± 0.0006 Å |
| c | 25.9099 ± 0.0013 Å |
| α | 90° |
| β | 97.126 ± 0.002° |
| γ | 90° |
| Cell volume | 1991.51 ± 0.15 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 3 |
| 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 | 0.067 |
| Residual factor for significantly intense reflections | 0.042 |
| Weighted residual factors for significantly intense reflections | 0.0949 |
| Weighted residual factors for all reflections included in the refinement | 0.1063 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/1576974.html
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Users of the data should acknowledge the original authors of the
structural data.