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Information card for entry 1555188
Preview
| Coordinates | 1555188.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H20 Cl N O2 S |
|---|---|
| Calculated formula | C19 H20 Cl N O2 S |
| Title of publication | Stereoselective Synthesis of Enantioenriched 2-Chloro-2-aroylaziridines by Cascade Reaction between Aryl Nitriles, Silyldichloromethanes, and tert-Butanesulfinylimines. |
| Authors of publication | Huang, Ze-Ao; Liu, Hui; Lu, Chong-Dao; Xu, Yan-Jun |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 16 |
| Pages of publication | 4042 - 4045 |
| a | 10.133 ± 0.003 Å |
| b | 9.753 ± 0.003 Å |
| c | 19.638 ± 0.005 Å |
| α | 90° |
| β | 100.289 ± 0.004° |
| γ | 90° |
| Cell volume | 1909.6 ± 0.9 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.126 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.0957 |
| Weighted residual factors for all reflections included in the refinement | 0.12 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238377 (current) | 2019-11-24 | cif/ Adding structures of 1555188 via cif-deposit CGI script. |
1555188.cif |
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