Information card for entry 2226652

Structure parameters

• Chemical name: 1,3-Bis(3,5-dimethylphenyl)-5-methylbenzene
• Formula: C23 H24
• Calculated formula: C23 H24
• SMILES: Cc1cc(cc(c1)c1cc(cc(c1)C)C)c1cc(cc(c1)C)C
• Title of publication: 1,3-Bis(3,5-dimethylphenyl)-5-methylbenzene
• Authors of publication: Lei, Ke-Wei; Xia, Dong-Guo; Li, Jie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1840
• a: 14.955 ± 0.002 Å
• b: 7.6081 ± 0.0012 Å
• c: 16.207 ± 0.002 Å
• α: 90°
• β: 106.839 ± 0.002°
• γ: 90°
• Cell volume: 1765 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 2
• 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: 0.0564
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1211
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes