Information card for entry 2102480

Structure parameters

• Common name: 2-biphenylol
• Formula: C12 H10 O
• Calculated formula: C12 H9 O
• SMILES: Oc1ccccc1c1ccccc1O
• Title of publication: 2-Biphenylol revisited
• Authors of publication: Parkin, Sean; Hao, Xiang; Brock, Carolyn Pratt
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: 197 - 203
• a: 12.871 ± 0.003 Å
• b: 23.939 ± 0.005 Å
• c: 5.887 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1813.9 ± 0.7 ų
• Cell temperature: 305 ± 2 K
• Ambient diffraction temperature: 305 ± 2 K
• Number of distinct elements: 3
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.1026
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No