Information card for entry 4317901

Structure parameters

• Formula: C111 H96 Cl6 P6 Ru6 S8
• Calculated formula: C111 H96 Cl6 P6 Ru6 S8
• Title of publication: New Class of Ruthenium Sulfide Clusters: Ru4S6(PPh3)4, Ru5S6(PPh3)5, and Ru6S8(PPh3)6
• Authors of publication: Amanda L. Eckermann; Markus Wunder; Dieter Fenske; Thomas B. Rauchfuss; Scott R. Wilson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2004 - 2006
• a: 14.146 ± 0.007 Å
• b: 19.546 ± 0.01 Å
• c: 19.219 ± 0.01 Å
• α: 90°
• β: 102.156 ± 0.008°
• γ: 90°
• Cell volume: 5195 ± 5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0348
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0628
• Weighted residual factors for all reflections included in the refinement: 0.0653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No