Information card for entry 2225502

Structure parameters

• Chemical name: (Biphenyl-4-yl)(phenyl)methanone
• Formula: C19 H14 O
• Calculated formula: C19 H14 O
• SMILES: C(=O)(c1ccccc1)c1ccc(cc1)c1ccccc1
• Title of publication: (Biphenyl-4-yl)(phenyl)methanone
• Authors of publication: Saeed, Aamer; Samra, Shahid Ameen; Irfan, Madiha; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o926
• a: 6.1445 ± 0.0004 Å
• b: 7.4298 ± 0.0007 Å
• c: 29.014 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1324.56 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0795
• Residual factor for significantly intense reflections: 0.0769
• Weighted residual factors for significantly intense reflections: 0.1804
• Weighted residual factors for all reflections included in the refinement: 0.1817
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes