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Information card for entry 7230748
Preview
| Coordinates | 7230748.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H15 F2 N3 O3 |
|---|---|
| Calculated formula | C15 H15 F2 N3 O3 |
| Title of publication | A convenient approach to difluoromethylated all-carbon quaternary centers via Ni(ii)-catalyzed enantioselective Michael addition |
| Authors of publication | Yu, Xuan; Bai, Hui; Wang, Dong; Qin, Zhaohai; Li, Jia-Qi; Fu, Bin |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 35 |
| Pages of publication | 19402 |
| a | 9.3745 ± 0.0002 Å |
| b | 11.453 ± 0.0003 Å |
| c | 13.8901 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1491.33 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0336 |
| Residual factor for significantly intense reflections | 0.0329 |
| Weighted residual factors for significantly intense reflections | 0.0839 |
| Weighted residual factors for all reflections included in the refinement | 0.0848 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207985 (current) | 2018-05-25 | cif/ Adding structures of 7230748 via cif-deposit CGI script. |
7230748.cif |
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Users of the data should acknowledge the original authors of the
structural data.