Information card for entry 7132687

Structure parameters

• Formula: C20 H15 F O
• Calculated formula: C20 H15 F O
• Title of publication: Electrochemical aerobic Wacker-type oxygenation of triaryl substituted alkenes to 1,2,2-triarylethanones.
• Authors of publication: Zhang, Zhou; Li, Jin; Cai, Zhiwei; Kang, Songyao; Wang, Jian; Cui, Yue; Han, Siyuan; Sheng, Lei; Yin, Qing; Dai, Ang; Zhao, Weining; Zhao, Fangyuan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 22
• Pages of publication: 3035 - 3038
• a: 16.4099 ± 0.0016 Å
• b: 10.0684 ± 0.001 Å
• c: 18.6788 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3086.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0998
• Residual factor for significantly intense reflections: 0.0822
• Weighted residual factors for significantly intense reflections: 0.217
• Weighted residual factors for all reflections included in the refinement: 0.2324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No