Information card for entry 4035485

Structure parameters

• Formula: C82 H76 O3
• Calculated formula: C82 H76 O3
• Title of publication: 10-Mesityl-1,8-diphenylanthracene Dimer: Synthesis, Structure, and Properties.
• Authors of publication: Shirai, Atsumi; Sano, Hiroto; Nakamura, Yuki; Takashika, Masataka; Otani, Hiroyuki; Hasegawa, Masashi; Kato, Shin-Ichiro; Iyoda, Masahiko
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2018
• Journal volume: 83
• Journal issue: 7
• Pages of publication: 3857 - 3863
• a: 16.589 ± 0.001 Å
• b: 9.0335 ± 0.0004 Å
• c: 20.6981 ± 0.001 Å
• α: 90°
• β: 94.977 ± 0.007°
• γ: 90°
• Cell volume: 3090.1 ± 0.3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 3
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0882
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No