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Information card for entry 7112296
Preview
| Coordinates | 7112296.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H40 N2 O3 S |
|---|---|
| Calculated formula | C36 H40 N2 O3 S |
| SMILES | S(N[C@@]1(C(=O)N(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2c1cccc2)[C@@H](C)C=C)(C(C)(C)C)=O.OC |
| Title of publication | Zn-mediated asymmetric allylation of N-tert-butanesulfinyl ketimines: an efficient and practical access to chiral quaternary 3-aminooxindoles. |
| Authors of publication | Chen, Diao; Xu, Ming-Hua |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2013 |
| Journal volume | 49 |
| Journal issue | 13 |
| Pages of publication | 1327 - 1329 |
| a | 9.3474 ± 0.0011 Å |
| b | 11.7017 ± 0.0018 Å |
| c | 28.722 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3141.6 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0782 |
| Residual factor for significantly intense reflections | 0.0685 |
| Weighted residual factors for significantly intense reflections | 0.1802 |
| Weighted residual factors for all reflections included in the refinement | 0.1865 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.116 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 7108837 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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