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Information card for entry 4132609
Preview
| Coordinates | 4132609.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H27 N O6 |
|---|---|
| Calculated formula | C20 H27 N O6 |
| Title of publication | Total Synthesis of Isodihydrokoumine, (19 Z)-Taberpsychine, and (4 R)-Isodihydroukoumine N<sub>4</sub>-Oxide. |
| Authors of publication | Kerkovius, Jeff K.; Kerr, Michael A. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 27 |
| Pages of publication | 8415 - 8419 |
| a | 9.816 ± 0.003 Å |
| b | 18.649 ± 0.004 Å |
| c | 11.003 ± 0.002 Å |
| α | 90° |
| β | 98.09 ± 0.006° |
| γ | 90° |
| Cell volume | 1994.1 ± 0.8 Å3 |
| Cell temperature | 110 K |
| Ambient diffraction temperature | 110 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 all reflections | 0.0927 |
| Residual factor for significantly intense reflections | 0.0812 |
| Weighted residual factors for significantly intense reflections | 0.2478 |
| Weighted residual factors for all reflections included in the refinement | 0.2613 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242556 (current) | 2019-11-26 | cif/ Adding structures of 4132609 via cif-deposit CGI script. |
4132609.cif |
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