Information card for entry 2217367

Structure parameters

• Chemical name: (2-Chlorophenyl)(diphenylphosphoryl)methanol
• Formula: C19 H16 Cl O2 P
• Calculated formula: C19 H16 Cl O2 P
• SMILES: P(=O)([C@H](c1c(Cl)cccc1)O)(c1ccccc1)c1ccccc1
• Title of publication: (2-Chlorophenyl)(diphenylphosphoryl)methanol
• Authors of publication: Liu, Wan-Yun; Huo, Ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o233 - o233
• a: 9.0943 ± 0.0004 Å
• b: 10.9172 ± 0.0006 Å
• c: 18.0657 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1793.64 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.053
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No