Information card for entry 5000381

Structure parameters

• Chemical name: 1,2,3,4,5,6,7,8-Octaphenyl-9-fluorenone
• Formula: C61 H40 O
• Calculated formula: C61 H40 O
• 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: 15.031 ± 0.002 Å
• b: 11.437 ± 0.002 Å
• c: 12.326 ± 0.001 Å
• α: 90°
• β: 96.702 ± 0.008°
• γ: 90°
• Cell volume: 2104.48 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 K
• Number of distinct elements: 3
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1645
• Residual factor for significantly intense reflections: 7.84
• Weighted residual factors for all reflections: 0.3079
• Weighted residual factors for significantly intense reflections: 7.84
• Goodness-of-fit parameter for all reflections: 0.962
• Goodness-of-fit parameter for significantly intense reflections: 1.289
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No