Information card for entry 4320980

Structure parameters

• Formula: C30 H24 Cl2 N6 O8
• Calculated formula: C30 H24 Cl2 N6 O7.65
• Title of publication: Synthesis and Characterization of the Dimethyl-Substituted Bisbenzimidazole Ligand and Its Manganese Complex
• Authors of publication: Wai Him Kwok; Huichang Zhang; Pramatha Payra; Maosheng Duan; Shao-ching Hung; Dean H. Johnston; Judith Gallucci; Ewa Skrzypczak-Jankun; Michael K. Chan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 2367 - 2376
• a: 8.7086 ± 0.0002 Å
• b: 28.8382 ± 0.0007 Å
• c: 11.9403 ± 0.0003 Å
• α: 90°
• β: 100.147 ± 0.001°
• γ: 90°
• Cell volume: 2951.79 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1686
• Residual factor for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections: 0.2577
• Weighted residual factors for significantly intense reflections: 0.2156
• Goodness-of-fit parameter for all reflections: 1.039
• Goodness-of-fit parameter for significantly intense reflections: 1.19
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No