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Information card for entry 1555480
Preview
| Coordinates | 1555480.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H18 Br N |
|---|---|
| Calculated formula | C21 H18 Br N |
| Title of publication | Enantioselective Metal-Free Hydrogenations of Disubstituted Quinolines. |
| Authors of publication | Zhang, Zhenhua; Du, Haifeng |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 24 |
| Pages of publication | 6266 - 6269 |
| a | 10.094 ± 0.003 Å |
| b | 14.285 ± 0.004 Å |
| c | 11.689 ± 0.003 Å |
| α | 90° |
| β | 90.952 ± 0.004° |
| γ | 90° |
| Cell volume | 1685.2 ± 0.8 Å3 |
| Cell temperature | 173.15 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0402 |
| Residual factor for significantly intense reflections | 0.0362 |
| Weighted residual factors for significantly intense reflections | 0.0687 |
| Weighted residual factors for all reflections included in the refinement | 0.0708 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238762 (current) | 2019-11-24 | cif/ Adding structures of 1555480 via cif-deposit CGI script. |
1555480.cif |
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Users of the data should acknowledge the original authors of the
structural data.