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Information card for entry 1570279
Preview
| Coordinates | 1570279.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Nandrolone_undecanoate |
|---|---|
| Chemical name | 19_nortestosterone_17β_undecanoate |
| Formula | C29 H46 O3 |
| Calculated formula | C29 H46 O3 |
| Title of publication | Crystal Structure and Intermolecular Energy for Some Nandrolone Esters. |
| Authors of publication | Mare, Liviu; Muresan-Pop, Marieta; Purcea Lopes, Pompilia Mioara; Turza, Alexandru; Borodi, Gheorghe; Popescu, Violeta |
| Journal of publication | Molecules (Basel, Switzerland) |
| Year of publication | 2023 |
| Journal volume | 28 |
| Journal issue | 20 |
| Pages of publication | 7179 |
| a | 9.9889 ± 0.0006 Å |
| b | 8.2547 ± 0.0005 Å |
| c | 32.9847 ± 0.0014 Å |
| α | 90° |
| β | 94.761 ± 0.005° |
| γ | 90° |
| Cell volume | 2710.4 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.2801 |
| Residual factor for significantly intense reflections | 0.0865 |
| Weighted residual factors for significantly intense reflections | 0.1462 |
| Weighted residual factors for all reflections included in the refinement | 0.2189 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.978 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287463 (current) | 2023-11-07 | cif/ Adding structures of 1570279 via cif-deposit CGI script. |
1570279.cif |
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Users of the data should acknowledge the original authors of the
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