Information card for entry 4110250

Structure parameters

• Formula: C26 H32 Cl11 Sb
• Calculated formula: C26 H32 Cl12 Sb
• Title of publication: Structural Studies on the Radical Cations of Benzene, Naphthalene, Biphenylene, and Anthracene Fully Annelated with Bicyclo[2.2.2]octene Frameworks [J.Am. Chem.Soc.2000,122, 10007-10016].
• Authors of publication: Akira Matsuura; Tohru Nishinaga; Koichi Komatsu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 14830 - 14830
• a: 18.344 ± 0.004 Å
• b: 12.128 ± 0.002 Å
• c: 15.01 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3339.4 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No