Information card for entry 7009842

Structure parameters

• Formula: C104 H140 F12 N12 O6 P2 Ru2
• Calculated formula: C104 H140 F12 N12 O6 P2 Ru2
• Title of publication: Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide
• Authors of publication: Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2000
• Journal issue: 20
• Pages of publication: 3649 - 3657
• a: 12.3749 ± 0.0003 Å
• b: 14.4512 ± 0.0004 Å
• c: 16.6108 ± 0.0005 Å
• α: 80.763 ± 0.002°
• β: 88.971 ± 0.002°
• γ: 75.717 ± 0.002°
• Cell volume: 2840.67 ± 0.14 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1552
• Weighted residual factors for all reflections included in the refinement: 0.1686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No