Information card for entry 7134809

Structure parameters

• Formula: C20 H15 O P
• Calculated formula: C20 H15 O P
• Title of publication: Electrochemical phosphorylation of α,β-unsaturated carboxylic acids <i>via</i> decarboxylative cross-coupling reaction.
• Authors of publication: Zhang, Zhaoqi; Shen, Yirui; Zhao, Yufen; Wu, Ju
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 64
• Pages of publication: 12034 - 12037
• a: 11.7526 ± 0.0009 Å
• b: 16.3049 ± 0.0015 Å
• c: 16.4854 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3159 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 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: 0.0543
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1017
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No