Information card for entry 4305644

Structure parameters

• Formula: C48 H82 B40 O Ru4 S12
• Calculated formula: C48 H82 B40 O Ru4 S12
• Title of publication: Mixed-Valent Diruthenium Half-Sandwich Complexes Containing Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity towards Phenylacetylene, 1,4-Diethynylbenzene, and Ethynylferrocene
• Authors of publication: Dehong Wu; Yuguang Li; Lei Han; Yizhi Li; Hong Yan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 6524 - 6531
• a: 14.2417 ± 0.0012 Å
• b: 18.6394 ± 0.0016 Å
• c: 17.3441 ± 0.0015 Å
• α: 90°
• β: 108.579 ± 0.001°
• γ: 90°
• Cell volume: 4364.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0631
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No