Information card for entry 2006943

Structure parameters

• Formula: C20 H18
• Calculated formula: C20 H18
• SMILES: Cc1cccc(c1)c1ccc(cc1)c1cccc(c1)C
• Title of publication: 3,3''-Dimethyl-1,1':4',1''-terphenyl
• Authors of publication: Avery, Tom D.; Taylor, Dennis K.; Tiekink, Edward R.T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 148 - 149
• a: 7.983 ± 0.002 Å
• b: 10.908 ± 0.001 Å
• c: 9.264 ± 0.001 Å
• α: 90°
• β: 114.51 ± 0.01°
• γ: 90°
• Cell volume: 734 ± 0.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.068
• Goodness-of-fit parameter for significantly intense reflections: 2.828
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No