Information card for entry 8101949

Structure parameters

• Chemical name: (diphenylphosphinoyl)phenylmethanol
• Formula: C19 H17 O2 P
• Calculated formula: C19 H17 O2 P
• SMILES: P(=O)(C(O)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of (diphenylphosphinoyl)phenylmethanol, C~19~H~17~O~2~P
• Authors of publication: Lan, K.; Chen, X.-L.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 2
• Pages of publication: 171 - 172
• a: 11.239 ± 0.004 Å
• b: 6.31 ± 0.002 Å
• c: 22.157 ± 0.008 Å
• α: 90°
• β: 92.091 ± 0.007°
• γ: 90°
• Cell volume: 1570.3 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No