Information card for entry 4132658

Structure parameters

• Formula: C32 H36 N2 O10
• Calculated formula: C32 H36 N2 O10
• SMILES: O(C(=O)N1C(=O)[C@@]([C@]2(C(=O)N(C(=O)OC(C)(C)C)c3ccccc23)CC(=O)OC)(CC(=O)OC)c2c1cccc2)C(C)(C)C
• Title of publication: Organo-Cation Catalyzed Asymmetric Homo/Heterodialkylation of Bisoxindoles: Construction of Vicinal All-Carbon Quaternary Stereocenters and Total Synthesis of (-)-Chimonanthidine.
• Authors of publication: Chen, Si-Kai; Ma, Wen-Qiang; Yan, Zhi-Bo; Zhang, Fu-Min; Wang, Shao-Hua; Tu, Yong-Qiang; Zhang, Xiao-Ming; Tian, Jin-Miao
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 32
• Pages of publication: 10099 - 10103
• a: 11.494 ± 0.0002 Å
• b: 11.7725 ± 0.0002 Å
• c: 12.7954 ± 0.0003 Å
• α: 78.086 ± 0.001°
• β: 76.309 ± 0.001°
• γ: 77.663 ± 0.001°
• Cell volume: 1621.03 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 149.99 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1136
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No