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Information card for entry 7239053
Preview
| Coordinates | 7239053.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C19 H28 O2 |
|---|---|
| Calculated formula | C19 H28 O2 |
| Title of publication | Direct organocatalytic stereoselective transfer hydrogenation of conjugated olefins of steroids |
| Authors of publication | Ramachary, Dhevalapally B.; Sakthidevi, Rajasekar; Reddy, P. Srinivasa |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 32 |
| Pages of publication | 13497 |
| a | 7.9253 ± 0.0018 Å |
| b | 8.4074 ± 0.0017 Å |
| c | 25.074 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1670.7 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0877 |
| Residual factor for significantly intense reflections | 0.0588 |
| Weighted residual factors for significantly intense reflections | 0.1188 |
| Weighted residual factors for all reflections included in the refinement | 0.1356 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7239053.cif |
| 244524 | 2019-11-28 | cif/ Adding structures of 7239052, 7239053 via cif-deposit CGI script. |
7239053.cif |
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Users of the data should acknowledge the original authors of the
structural data.