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Information card for entry 4035853
Preview
| Coordinates | 4035853.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H33 N O3 S |
|---|---|
| Calculated formula | C23 H33 N O3 S |
| SMILES | S(=O)(N[C@H](c1c(OC)ccc(Cc2ccc(OC)cc2)c1)C(C)C)C(C)(C)C |
| Title of publication | Asymmetric Synthesis of α-(Diarylmethyl) Alkyl Amines through Regioselective Lithiation of α-Diarylmethanes and the Diastereoselective Addition to Ellman's Imines. |
| Authors of publication | Reddy, Leleti Rajender; Kotturi, Sharadsrikar; Waman, Yogesh; Patel, Chirag; Danidharia, Megha; Shenoy, Rajesh |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2018 |
| Journal volume | 83 |
| Journal issue | 12 |
| Pages of publication | 6573 - 6579 |
| a | 9.76 ± 0.03 Å |
| b | 8.667 ± 0.017 Å |
| c | 27.31 ± 0.05 Å |
| α | 90.08 ± 0.09° |
| β | 91.13 ± 0.14° |
| γ | 89.89 ± 0.09° |
| Cell volume | 2310 ± 9 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for significantly intense reflections | 0.082 |
| Weighted residual factors for all reflections included in the refinement | 0.2058 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.951 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227265 (current) | 2019-11-11 | cif/ Adding structures of 4035853 via cif-deposit CGI script. |
4035853.cif |
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Users of the data should acknowledge the original authors of the
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