Information card for entry 8107437

Structure parameters

• Chemical name: 1,2,3,5,13-pentamethoxy-6,7-dimethyl-1,2,3,4, 4a,5,6,7,8,13b-decahydrobenzo[3',4'] cycloocta[1',2':4,5]benzo[1,2-<i>d</i>][1,3]dioxole
• Formula: C24 H30 O7
• Calculated formula: C24 H30 O7
• Title of publication: Crystal structure of 1,2,3,5,13-pentamethoxy-6,7-dimethyl-1,2,3,4,4a,5,6,7,8,13b-decahydrobenzo[3′,4′]cycloocta[1′,2′:4,5]benzo[1,2-d][1,3]dioxole, C24H30O7
• Authors of publication: Chen, Ren-Song; Ye, Jiang-Hai; Luo, Yu-Ling; Xu, Chuan-Yan; Zou, Juan; Zhang, Jing-Jie
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 2
• Pages of publication: 349 - 351
• a: 11.4194 ± 0.0005 Å
• b: 13.4657 ± 0.0006 Å
• c: 14.7549 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2268.86 ± 0.18 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.1295
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1014
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No