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Information card for entry 1520022
Preview
| Coordinates | 1520022.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H13 Cl O2 |
|---|---|
| Calculated formula | C12 H13 Cl O2 |
| SMILES | Clc1ccc([C@H](O)[C@@H]2C(=O)CCC2)cc1 |
| Title of publication | Chiral Brønsted Acid as a True Catalyst: Asymmetric Mukaiyama Aldol and Hosomi-Sakurai Allylation Reactions. |
| Authors of publication | Sai, Masahiro; Yamamoto, Hisashi |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Journal volume | 137 |
| Journal issue | 22 |
| Pages of publication | 7091 - 7094 |
| a | 5.8119 ± 0.0015 Å |
| b | 10.51 ± 0.003 Å |
| c | 18.411 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1124.6 ± 0.5 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for significantly intense reflections | 0.0613 |
| Weighted residual factors for all reflections included in the refinement | 0.1186 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 140108 (current) | 2015-07-05 | cif/ Updating files of 1520022 Original log message: Adding full bibliography for 1520022.cif. |
1520022.cif |
| 137432 | 2015-05-28 | cif/ Adding structures of 1520022 via cif-deposit CGI script. |
1520022.cif |
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