Information card for entry 4337083

Structure parameters

• Formula: C63 H51 I4 N17 Ru2
• Calculated formula: C63 H50.25 I4 N17 Ru2
• Title of publication: Component analysis of dyads designed for light-driven water oxidation.
• Authors of publication: Kohler, Lars; Kaveevivitchai, Nattawut; Zong, Ruifa; Thummel, Randolph P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 2
• Pages of publication: 912 - 921
• a: 13.3193 ± 0.0013 Å
• b: 25.503 ± 0.002 Å
• c: 20.0756 ± 0.0019 Å
• α: 90°
• β: 104.871 ± 0.002°
• γ: 90°
• Cell volume: 6590.9 ± 1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1079
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.274
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No