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Information card for entry 1570278
Preview
| Coordinates | 1570278.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Nandrolone_propionate |
|---|---|
| Chemical name | 19_nortestosterone_17β-propionate_hemihydrate |
| Formula | C42 H62 O6.5 |
| Calculated formula | C42 H62 O6.5 |
| 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 | 7.761 ± 0.0002 Å |
| b | 7.761 ± 0.0002 Å |
| c | 56.211 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 2932.16 ± 0.14 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 152 |
| Hermann-Mauguin space group symbol | P 31 2 1 |
| Hall space group symbol | P 31 2" |
| Residual factor for all reflections | 0.0827 |
| Residual factor for significantly intense reflections | 0.068 |
| Weighted residual factors for significantly intense reflections | 0.2032 |
| Weighted residual factors for all reflections included in the refinement | 0.221 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287462 (current) | 2023-11-07 | cif/ Adding structures of 1570278 via cif-deposit CGI script. |
1570278.cif |
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