Information card for entry 4038911

Structure parameters

• Formula: C27 H33 Cl2 N O10
• Calculated formula: C27 H33 Cl2 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: 8.0864 ± 0.0013 Å
• b: 12.184 ± 0.002 Å
• c: 15.082 ± 0.003 Å
• α: 104.931 ± 0.003°
• β: 105.413 ± 0.002°
• γ: 92.31 ± 0.003°
• Cell volume: 1374.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1213
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.3081
• Weighted residual factors for all reflections included in the refinement: 0.3293
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No