Information card for entry 4344000

Structure parameters

• Formula: C57 H40 Cl3 N11 O16 Ru2
• Calculated formula: C57 H40 Cl3 N11 O16 Ru2
• Title of publication: New Series of Dinuclear Ruthenium(II) Complexes Synthesized Using Photoisomerization for Efficient Water Oxidation Catalysis.
• Authors of publication: Hirahara, Masanari; Nagai, Sho; Takahashi, Kosuke; Saito, Kenji; Yui, Tatsuto; Yagi, Masayuki
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 7627 - 7635
• a: 10.3757 ± 0.0005 Å
• b: 42.223 ± 0.002 Å
• c: 13.7118 ± 0.0007 Å
• α: 90°
• β: 91.351 ± 0.001°
• γ: 90°
• Cell volume: 6005.4 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1079
• Residual factor for significantly intense reflections: 0.0627
• Weighted residual factors for significantly intense reflections: 0.1708
• Weighted residual factors for all reflections included in the refinement: 0.1999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No