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Information card for entry 1577348
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| Coordinates | Coordinates are not available: file is not found. |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H12 B Br F20 O |
|---|---|
| Calculated formula | C29 H12 B Br F20 O |
| Title of publication | Conversion of trifluoromethyls into esters along with polyether upcycling <i>via</i> cation-transfer-catalyzed C-O/C-F metathesis. |
| Authors of publication | Li, Zhuojun; Shi, Xiangqian; Zhang, Dongke; Wu, Qian |
| Journal of publication | Chemical science |
| Year of publication | 2026 |
| Journal volume | 17 |
| Journal issue | 20 |
| Pages of publication | 9952 - 9959 |
| a | 14.5795 ± 0.0001 Å |
| b | 11.3766 ± 0.0001 Å |
| c | 17.9416 ± 0.0001 Å |
| α | 90° |
| β | 90.463 ± 0.001° |
| γ | 90° |
| Cell volume | 2975.79 ± 0.04 Å3 |
| Cell temperature | 113.15 K |
| Ambient diffraction temperature | 113.15 K |
| Number of distinct elements | 6 |
| 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 | 0.0694 |
| Residual factor for significantly intense reflections | 0.0687 |
| Weighted residual factors for significantly intense reflections | 0.2108 |
| Weighted residual factors for all reflections included in the refinement | 0.2113 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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structural data.