Information card for entry 4340437

Structure parameters

• Formula: C78 H64 Cl4 N9 O Ru2
• Calculated formula: C78 H64 Cl4 N9 O Ru2
• Title of publication: Effect of axial ligands on the spectroscopic and electrochemical properties of diruthenium compounds.
• Authors of publication: Manowong, Machima; Han, Baocheng; McAloon, Thomas R.; Shao, Jianguo; Guzei, Ilia A.; Ngubane, Siyabonga; Van Caemelbecke, Eric; Bear, John L.; Kadish, Karl M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 14
• Pages of publication: 7416 - 7428
• a: 13.9376 ± 0.0017 Å
• b: 26.624 ± 0.003 Å
• c: 19.344 ± 0.002 Å
• α: 90°
• β: 91.94 ± 0.002°
• γ: 90°
• Cell volume: 7174 ± 1.4 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 105 ± 2 K
• Number of distinct elements: 6
• 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: 0.0726
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1322
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No