Information card for entry 4133617

Structure parameters

• Formula: C25 H20 Cl3 F3 N2 O4
• Calculated formula: C25 H20 Cl3 F3 N2 O4
• Title of publication: Cu/Chiral Phosphoric Acid-Catalyzed Asymmetric Three-Component Radical-Initiated 1,2-Dicarbofunctionalization of Alkenes.
• Authors of publication: Lin, Jin-Shun; Li, Tao-Tao; Liu, Ji-Ren; Jiao, Guan-Yuan; Gu, Qiang-Shuai; Cheng, Jiang-Tao; Guo, Yu-Long; Hong, Xin; Liu, Xin-Yuan
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 2
• Pages of publication: 1074 - 1083
• a: 22.0755 ± 0.0004 Å
• b: 22.0755 ± 0.0004 Å
• c: 10.0326 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4234.14 ± 0.14 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 168
• Hermann-Mauguin space group symbol: P 6
• Hall space group symbol: P 6
• Residual factor for all reflections: 0.0863
• Residual factor for significantly intense reflections: 0.081
• Weighted residual factors for significantly intense reflections: 0.2259
• Weighted residual factors for all reflections included in the refinement: 0.2342
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No