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Information card for entry 7248856
Preview
| Coordinates | 7248856.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H22 Br F3 N2 O3 |
|---|---|
| Calculated formula | C27 H24 Br F3 N2 O3 |
| Title of publication | N-heterocyclic carbene catalyzed [2 + 3] annulation reaction for the synthesis of trifluoroethyl 3,2'-spirooxindole γ-lactam. |
| Authors of publication | Pu, Yiru; Wang, Maolin; Tian, Wanrong; Ge, Xian; Zhu, Dikai; Wang, Chuanqi; Zeng, Yingjie; Tao, Feiyan; Deng, Yun; Lu, Jun |
| Journal of publication | RSC advances |
| Year of publication | 2024 |
| Journal volume | 14 |
| Journal issue | 26 |
| Pages of publication | 18453 - 18458 |
| a | 11.3667 ± 0.0003 Å |
| b | 7.8133 ± 0.0002 Å |
| c | 14.3984 ± 0.0004 Å |
| α | 90° |
| β | 105.313 ± 0.001° |
| γ | 90° |
| Cell volume | 1233.34 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0367 |
| Residual factor for significantly intense reflections | 0.0346 |
| Weighted residual factors for significantly intense reflections | 0.1131 |
| Weighted residual factors for all reflections included in the refinement | 0.1171 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292344 (current) | 2024-06-13 | cif/ Adding structures of 7248856 via cif-deposit CGI script. |
7248856.cif |
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Users of the data should acknowledge the original authors of the
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