Information card for entry 2204256

Structure parameters

• Common name: tetramethyl terphenyl
• Chemical name: 3,3',5,5'-tetramethylterphenyl
• Formula: C22 H22
• Calculated formula: C22 H22
• SMILES: Cc1cc(cc(c1)C)c1ccc(cc1)c1cc(C)cc(c1)C
• Title of publication: 3,3',5,5'-Tetramethylterphenyl
• Authors of publication: Xu, Jiyang; Côté, Adrien P.; Chen, Banglin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: o1697 - o1698
• a: 11.9264 ± 0.0013 Å
• b: 9.2297 ± 0.001 Å
• c: 7.6075 ± 0.0008 Å
• α: 90°
• β: 105.381 ± 0.002°
• γ: 90°
• Cell volume: 807.42 ± 0.15 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0527
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.1766
• Goodness-of-fit parameter for all reflections included in the refinement: 0.743
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes