Information card for entry 4020148

Structure parameters

• Chemical name: 1,8-Bis(3,3'-bis(3,5-dimethylphenyl)-9,9'-diacridyl) naphthalene N,N-dioxides
• Formula: C54 H42 Cl4 N2 O2
• Calculated formula: C54 H42 Cl4 N2 O2
• Authors of publication: Xuefeng Mei; Christian Wolf
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 2299 - 2305
• a: 13.8017 ± 0.0012 Å
• b: 11.308 ± 0.001 Å
• c: 15.029 ± 0.0014 Å
• α: 90°
• β: 113.116 ± 0.002°
• γ: 90°
• Cell volume: 2157.2 ± 0.3 ų
• Cell temperature: 187 ± 2 K
• Ambient diffraction temperature: 187 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0954
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1789
• Weighted residual factors for all reflections included in the refinement: 0.1958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No