Information card for entry 7157636

Structure parameters

• Formula: C17 H28 O4
• Calculated formula: C17 H28 O4
• Title of publication: Highly stereocontrolled total synthesis of secodolastane diterpenoid isolinearol.
• Authors of publication: Kobayashi, Toyoharu; Tomita, Yui; Kawamoto, Yuichiro; Ito, Hisanaka
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2020
• Journal volume: 18
• Journal issue: 37
• Pages of publication: 7316 - 7320
• a: 15.2304 ± 0.0014 Å
• b: 9.1246 ± 0.0008 Å
• c: 22.238 ± 0.002 Å
• α: 90°
• β: 95.627 ± 0.001°
• γ: 90°
• Cell volume: 3075.6 ± 0.5 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.1352
• Weighted residual factors for all reflections included in the refinement: 0.1432
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No