Information card for entry 2206660

Structure parameters

• Formula: C15 H14 O2
• Calculated formula: C15 H14 O2
• SMILES: O(c1ccc(C(=O)c2cc(ccc2)C)cc1)C
• Title of publication: (4-Methoxyphenyl)(2-methylphenyl)methanone
• Authors of publication: Mahendra, M; Khanum, S. A.; Singh, A.; Shashikanth, S.; Doreswamy, B. H.; Sridhar, M. A.; Shashidhara Prasad, J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: o2990 - o2991
• a: 7.592 ± 0.004 Å
• b: 14.147 ± 0.007 Å
• c: 11.342 ± 0.007 Å
• α: 90°
• β: 95.231 ± 0.002°
• γ: 90°
• Cell volume: 1213.1 ± 1.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• 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: 0.0555
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1278
• Weighted residual factors for all reflections included in the refinement: 0.1427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.189
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes