Information card for entry 7248886

Structure parameters

• Formula: C33 H31 N2 O3 P
• Calculated formula: C33 H31 N2 O3 P
• Title of publication: Electrochemically enabled cobalt catalyzed enantioselective C–H acyloxylation of aryl phosphamide with carboxylic acid
• Authors of publication: Xia, Xuying; Zheng, Changdi; Hang, Yunfei; Guo, Jiyuan; Liu, Tao; Song, Dingguo; Chen, Zhiwei; Zhong, Weihui; Ling, Fei
• Journal of publication: Green Chemistry
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 8323 - 8329
• a: 9.7228 ± 0.0003 Å
• b: 15.2917 ± 0.0005 Å
• c: 19.0023 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2825.23 ± 0.15 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 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: 0.0367
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No