Information card for entry 7130851

Structure parameters

• Formula: C26 H26 O4 P2
• Calculated formula: C26 H26 O4 P2
• 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: 8.7292 ± 0.0002 Å
• b: 12.454 ± 0.0002 Å
• c: 21.6161 ± 0.0003 Å
• α: 90°
• β: 92.026 ± 0.002°
• γ: 90°
• Cell volume: 2348.49 ± 0.07 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No