Information card for entry 1570278

Structure parameters

• 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 ų
• 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