Information card for entry 4316106

Structure parameters

• Formula: C51 H73 Ir P2 Re2 S7 Si4
• Calculated formula: C51 H64 Ir P2 Re2 S7 Si4
• Title of publication: Core Conversion Reactions of the Cubane-Type Metal-Sulfido Clusters: Shape Shift, Contraction, and Expansion of the MM'Re2S4 Cubanes (M = Ir, Rh, Ru; M' = Pt, Pd)
• Authors of publication: Rie Shibata; Hidetake Seino; Shunpei Fujii; Yasushi Mizobe
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 6889 - 6896
• a: 9.9237 ± 0.0003 Å
• b: 11.3495 ± 0.0003 Å
• c: 56.9097 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6409.7 ± 0.3 ų
• Cell temperature: 293.1 K
• Ambient diffraction temperature: 293.1 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for all reflections included in the refinement: 0.1015
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No