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Information card for entry 1573677
Preview
| Coordinates | 1573677.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H15 B F2 I N O6 |
|---|---|
| Calculated formula | C11 H15 B F2 I N O6 |
| Title of publication | B(MIDA)-directed site-selective intermolecular halofluoroalkylation of alkenes: synthesis of diversely functionalized building blocks |
| Authors of publication | Wu, Hengbo; Luo, Ruitong; Peng, Jingjing; Han, Zijian; Zhang, Renjie; Xu, Zhijian; Zhu, Weiliang; Liu, Hong; Li, Chunpu |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 51.208 ± 0.005 Å |
| b | 7.1184 ± 0.0007 Å |
| c | 31.56 ± 0.004 Å |
| α | 90° |
| β | 126.597 ± 0.007° |
| γ | 90° |
| Cell volume | 9236.1 ± 1.9 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0662 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.0845 |
| Weighted residual factors for all reflections included in the refinement | 0.0963 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297277 (current) | 2025-01-11 | cif/ Adding structures of 1573677 via cif-deposit CGI script. |
1573677.cif |
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Users of the data should acknowledge the original authors of the
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