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Information card for entry 4119732
Preview
| Coordinates | 4119732.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H22 N2 O2 S |
|---|---|
| Calculated formula | C20 H22 N2 O2 S |
| Title of publication | Catalytic Asymmetric Synthesis of Pyrroloindolines via a Rhodium(II)-Catalyzed Annulation of Indoles |
| Authors of publication | Jillian E. Spangler; Huw M. L. Davies |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2013 |
| Journal volume | 135 |
| Pages of publication | 6802 - 6805 |
| a | 10.0751 ± 0.0012 Å |
| b | 10.7241 ± 0.0013 Å |
| c | 16.6027 ± 0.0019 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1793.9 ± 0.4 Å3 |
| 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 | 0.05156 |
| Residual factor for significantly intense reflections | 0.048183 |
| Weighted residual factors for all reflections included in the refinement | 0.124917 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05404 |
| Diffraction radiation wavelength | 0.71073 Å |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178968 (current) | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/97. |
4119732.cif |
| 103908 | 2014-03-07 | cif/ Adding structures of 4119732 via cif-deposit CGI script. |
4119732.cif |
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Users of the data should acknowledge the original authors of the
structural data.