Information card for entry 2221671

Structure parameters

• Chemical name: 1,2-Dimethyl-4,5-diphenylbenzene
• Formula: C20 H18
• Calculated formula: C20 H18
• SMILES: Cc1cc(c2ccccc2)c(cc1C)c1ccccc1
• Title of publication: 1,2-Dimethyl-4,5-diphenylbenzene determined on a Bruker SMART X2S benchtop crystallographic system
• Authors of publication: Briggs, Jonathan B.; Jazdzyk, Mikaël D.; Miller, Glen P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: o1171
• a: 9.3033 ± 0.0007 Å
• b: 10.7546 ± 0.0009 Å
• c: 16.3322 ± 0.0012 Å
• α: 93.793 ± 0.003°
• β: 98.934 ± 0.003°
• γ: 106.549 ± 0.002°
• Cell volume: 1536.8 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1247
• Weighted residual factors for all reflections included in the refinement: 0.166
• Goodness-of-fit parameter for all reflections included in the refinement: 0.874
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes