Information card for entry 4320842

Structure parameters

• Formula: C57 H70.5 Cl2 N11.5 O Ru
• Calculated formula: C57 H68.5 Cl2 N11.5 O Ru
• Title of publication: A Bibenzimidazole-Containing Ruthenium(II) Complex Acting as a Cation-Driven Molecular Switch
• Authors of publication: Sven Rau; Torsten Büttner; Christian Temme; Mario Ruben; Helmar Görls; Dirk Walther; Marco Duati; Stefano Fanni; Johannes G. Vos
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 1621 - 1624
• a: 12.1079 ± 0.0004 Å
• b: 13.021 ± 0.0003 Å
• c: 19.9806 ± 0.0007 Å
• α: 83.201 ± 0.002°
• β: 75.194 ± 0.002°
• γ: 73.809 ± 0.002°
• Cell volume: 2920.93 ± 0.16 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections: 0.105
• Weighted residual factors for significantly intense reflections: 0.1002
• Goodness-of-fit parameter for all reflections: 1.008
• Goodness-of-fit parameter for significantly intense reflections: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No