Information card for entry 4121565

Structure parameters

• Common name: XH_54_SPS
• Chemical name: maimone15
• Formula: C20 H28 O6
• Calculated formula: C20 H28 O6
• Title of publication: Four-Step Synthesis of the Antimalarial Cardamom Peroxide via an Oxygen Stitching Strategy.
• Authors of publication: Hu, Xirui; Maimone, Thomas J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 14
• Pages of publication: 5287 - 5290
• a: 6.4231 ± 0.0005 Å
• b: 13.8311 ± 0.0009 Å
• c: 20.3077 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1804.1 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0725
• Residual factor for significantly intense reflections: 0.0714
• Weighted residual factors for significantly intense reflections: 0.1882
• Weighted residual factors for all reflections included in the refinement: 0.1901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No