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Information card for entry 1100243
Preview
| Coordinates | 1100243.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (2SR,3SR)-N-t-Butoxycarbonyl-2-benzyl-3-pyrrolidinol |
|---|---|
| Formula | C16 H23 N O3 |
| Calculated formula | C16 H23 N O3 |
| SMILES | N1([C@H]([C@@H](O)CC1)Cc1ccccc1)C(=O)OC(C)(C)C.N1([C@@H]([C@H](O)CC1)Cc1ccccc1)C(=O)OC(C)(C)C |
| Title of publication | The Synthesis of (+)-Preussin and Related Pyrrolidinols by Diastereoselective Paternò-Büchi Reactions of Chiral 2-Substituted 2,3-Dihydropyrroles |
| Authors of publication | Bach, Thorsten; Brummerhop, Harm; Harms, Klaus |
| Journal of publication | Chemistry - A European Journal |
| Year of publication | 2000 |
| Journal volume | 6 |
| Journal issue | 20 |
| Pages of publication | 3838 - 3848 |
| a | 13.318 ± 0.0004 Å |
| b | 6.836 ± 0.0002 Å |
| c | 17.3181 ± 0.0011 Å |
| α | 90° |
| β | 96.045 ± 0.005° |
| γ | 90° |
| Cell volume | 1567.91 Å3 |
| Ambient diffraction temperature | 213 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 3.97 |
| Weighted residual factors for significantly intense reflections | 3.97 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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