Information card for entry 4074049

Structure parameters

• Formula: C72 H162 B80 O13 Ru8 S24
• Calculated formula: C72 H162 B80 O13 Ru8 S24
• Title of publication: Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates
• Authors of publication: Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6300
• a: 13.434 ± 0.003 Å
• b: 14.267 ± 0.003 Å
• c: 23.072 ± 0.005 Å
• α: 90.101 ± 0.004°
• β: 97.344 ± 0.003°
• γ: 116.697 ± 0.003°
• Cell volume: 3909.5 ± 1.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0971
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No