Information card for entry 5000383

Structure parameters

• Common name: 2,4,6,2'4',6'-Hexaphenyl-1,1'-biphenyl
• Chemical name: 3',5',4'',6''-Tetraphenyl-1,1':2',1'':2'',1'''-quaterphenyl
• Formula: C48 H34
• Calculated formula: C48 H34
• Title of publication: Polyphenylbiphenyls and Polyphenylfluorenes
• Authors of publication: Ling Tong; Heidi Lau; Douglas M. Ho; Robert A. Pascal
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1998
• Journal volume: 120
• Pages of publication: 6000 - 6006
• a: 20.912 ± 0.002 Å
• b: 16.579 ± 0.001 Å
• c: 9.737 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3375.82 ų
• Cell temperature: 230 ± 2 K
• Ambient diffraction temperature: 230 K
• Number of distinct elements: 2
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.1306
• Residual factor for significantly intense reflections: 5.22
• Weighted residual factors for all reflections: 0.1372
• Weighted residual factors for significantly intense reflections: 5.22
• Goodness-of-fit parameter for all reflections: 0.826
• Goodness-of-fit parameter for significantly intense reflections: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No