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Information card for entry 7134723
Preview
| Coordinates | 7134723.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H27 F3 N2 O7 S |
|---|---|
| Calculated formula | C21 H27 F3 N2 O7 S |
| Title of publication | Electrochemical Site-Selective C(sp3)−H Amination of Alkyl Substituted Indoles and Pyrroles |
| Authors of publication | liu, shuai; Ge, Yongqi; Li, Jianan; Sheng, Xiaoyu; Zhang, Tian-Shu; Wu, Qiong; Ding, Weijie; Cheng, Xu |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 9.6415 ± 0.0008 Å |
| b | 10.1608 ± 0.0009 Å |
| c | 24.945 ± 0.002 Å |
| α | 90° |
| β | 95.477 ± 0.003° |
| γ | 90° |
| Cell volume | 2432.6 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.1232 |
| Residual factor for significantly intense reflections | 0.0751 |
| Weighted residual factors for significantly intense reflections | 0.1967 |
| Weighted residual factors for all reflections included in the refinement | 0.22 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.087 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300095 (current) | 2025-06-17 | cif/ Adding structures of 7134723 via cif-deposit CGI script. |
7134723.cif |
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Users of the data should acknowledge the original authors of the
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