Information card for entry 4325161

Structure parameters

• Formula: C108 H139.52 F12 N20 Na O25.76 P2 Ru4 S4
• Calculated formula: C108 H104 F12 N20 Na O25.75 P2 Ru4 S4
• SMILES: [Na]1([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([F][P]([F]1)(F)(F)(F)F)[OH2].[F-][P](F)(F)(F)(F)F.CCO.CCO.CCO.CCO.O.O.O.O.O
• Title of publication: Bis(bipyridine)ruthenium(II) Complexes with an Aliphatic Sulfinato Donor: Synthesis, Characterization, and Properties
• Authors of publication: Motoshi Tamura; Kiyoshi Tsuge; Asako Igashira-Kamiyama; Takumi Konno
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 4764 - 4771
• a: 17.0154 ± 0.0018 Å
• b: 17.0154 ± 0.0018 Å
• c: 45.5 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13173 ± 2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 9
• Space group number: 97
• Hermann-Mauguin space group symbol: I 4 2 2
• Hall space group symbol: I 4 2
• Residual factor for all reflections: 0.0575
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1952
• Weighted residual factors for all reflections included in the refinement: 0.1962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.759
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No