Information card for entry 4038912

Structure parameters

• Formula: C23 H25 N O10
• Calculated formula: C23 H25 N O10
• Title of publication: Total Synthesis of Dactylicapnosines A and B.
• Authors of publication: Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2020
• a: 10.3752 ± 0.0002 Å
• b: 9.7872 ± 0.0002 Å
• c: 21.5064 ± 0.0005 Å
• α: 90°
• β: 100.142 ± 0.001°
• γ: 90°
• Cell volume: 2149.73 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0479
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No