Information card for entry 2202969

Structure parameters

• Formula: C20 H29 F O3
• Calculated formula: C20 H29 F O3
• SMILES: F[C@H]1OC(=O)[C@H]2[C@@H]3[C@H]1[C@H]1C(CCC[C@@]1([C@H]3C[C@@H]1OCC[C@H]21)C)(C)C
• Title of publication: 21α-Fluoro-7-nor-12,13,15,16-tetrahydrovouacapane-17β,21α-lactone
• Authors of publication: Guilardi, Silvana; Resende, Jackson Antônio Lamounier Camargos; Gambardella, Maria Teresa do Prado; Demuner, Antonio Jacinto; Barbosa, Luis Claudio de Almeida; Piló-Veloso, Dorila
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 12
• Pages of publication: o1935 - o1937
• a: 6.0284 ± 0.0004 Å
• b: 10.85 ± 0.002 Å
• c: 26.921 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1760.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No