Information card for entry 4343999

Structure parameters

• Formula: C57 H41 B3 Cl F12 N11 O Ru2
• Calculated formula: C57 H39 B3 Cl F12 N11 O 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: 12.4423 ± 0.0014 Å
• b: 14.0988 ± 0.0017 Å
• c: 16.284 ± 0.002 Å
• α: 99.801 ± 0.006°
• β: 96.207 ± 0.008°
• γ: 91.836 ± 0.005°
• Cell volume: 2794.7 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1288
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1167
• Weighted residual factors for all reflections included in the refinement: 0.1629
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No