Information card for entry 7119686

Structure parameters

• Formula: C21 H27 N O S
• Calculated formula: C21 H27 N O S
• SMILES: S(N[C@@H]([C@@H](C=C)c1ccccc1)c1ccc(cc1)C)(=O)C(C)(C)C
• Title of publication: Asymmetric cinnamylation of N-tert-butanesulfinyl imines with cinnamyl acetates: total syntheses of (+)-lycoricidine and (+)-7-deoxypancratistatin.
• Authors of publication: Cai, Sen-Lin; Yuan, Bin-Hua; Jiang, Yi-Xiang; Lin, Guo-Qiang; Sun, Xing-Wen
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2017
• Journal volume: 53
• Journal issue: 25
• Pages of publication: 3520 - 3523
• a: 5.732 ± 0.008 Å
• b: 18.45 ± 0.02 Å
• c: 18.87 ± 0.03 Å
• α: 90°
• β: 90 ± 0.02°
• γ: 90°
• Cell volume: 1996 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.138
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1842
• Goodness-of-fit parameter for all reflections included in the refinement: 0.902
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No