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Information card for entry 7160085
Preview
| Coordinates | 7160085.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H20 Br F2 N O2 |
|---|---|
| Calculated formula | C25 H20 Br F2 N O2 |
| Title of publication | NHC catalyzed radical tandem cyclization: an efficient synthesis of α,α-difluoro-γ-lactam derivatives. |
| Authors of publication | Huang, Tianjiao; Yin, Huiping; Li, Tuanjie; Yu, Chenxia; Zhang, Kai; Yao, Changsheng |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2024 |
| Journal volume | 22 |
| Journal issue | 34 |
| Pages of publication | 6988 - 6998 |
| a | 10.1467 ± 0.0005 Å |
| b | 10.3698 ± 0.0005 Å |
| c | 11.2435 ± 0.0005 Å |
| α | 75.044 ± 0.002° |
| β | 76.595 ± 0.002° |
| γ | 76.84 ± 0.002° |
| Cell volume | 1093.94 ± 0.09 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1403 |
| Residual factor for significantly intense reflections | 0.082 |
| Weighted residual factors for significantly intense reflections | 0.1896 |
| Weighted residual factors for all reflections included in the refinement | 0.2325 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294637 (current) | 2024-09-06 | cif/ Updating files of 7160085, 7160086 Original log message: Adding full bibliography for 7160085--7160086.cif. |
7160085.cif |
| 293654 | 2024-08-03 | cif/ Adding structures of 7160085, 7160086 via cif-deposit CGI script. |
7160085.cif |
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Users of the data should acknowledge the original authors of the
structural data.