Information card for entry 7124286

Structure parameters

• Formula: C38 H38 Br2 N4 O4
• Calculated formula: C38 H38 Br2 N4 O4
• Title of publication: Asymmetric Aerobic Decarboxylative Povarov Reactions of N-Aryl α-Amino Acids with Methylenephthalimidines via Cooperative Photoredox and Chiral Brønsted Acid Catalysis
• Authors of publication: Li, Jiangtao; Gu, Ziwei; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 9.51375 ± 0.00016 Å
• b: 16.825 ± 0.0003 Å
• c: 22.3825 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3582.74 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0505
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1195
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No