Information card for entry 7130850

Structure parameters

• Formula: C38 H25 O P
• Calculated formula: C38 H25 O P
• Title of publication: Pd-catalysed, Ag-assisted C2–H alkenylation of benzophospholes
• Authors of publication: Tokura, Yu; Xu, Shibo; Kojima, Yuki; Miura, Masahiro; Hirano, Koji
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 8.413 ± 0.0003 Å
• b: 10.9151 ± 0.0005 Å
• c: 16.0946 ± 0.0007 Å
• α: 81.509 ± 0.004°
• β: 81.007 ± 0.003°
• γ: 86.633 ± 0.004°
• Cell volume: 1442.82 ± 0.11 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0645
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No