Information card for entry 1569389

Structure parameters

• Formula: C19 H17 N O
• Calculated formula: C19 H17 N O
• Title of publication: Catalytic asymmetric indolization by a desymmetrizing [3 + 2] annulation strategy.
• Authors of publication: Wu, Changhui; Chang, Zhiqian; Peng, Chuanyong; Bai, Chen; Xing, Junhao; Dou, Xiaowei
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 29
• Pages of publication: 7980 - 7987
• a: 9.1061 ± 0.0002 Å
• b: 12.0634 ± 0.0002 Å
• c: 14.0083 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1538.82 ± 0.05 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 4
• 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: 0.0339
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No