Information card for entry 4316107

Structure parameters

• Formula: C98 H111 Ir P4 Pd4 Re2 S8 Si4
• Calculated formula: C98 H93 Ir P4 Pd4 Re2 S8 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: 15.55 ± 0.004 Å
• b: 15.646 ± 0.004 Å
• c: 24.209 ± 0.006 Å
• α: 71.615 ± 0.007°
• β: 81.275 ± 0.01°
• γ: 75.918 ± 0.009°
• Cell volume: 5403 ± 2 ų
• Cell temperature: 293.1 K
• Ambient diffraction temperature: 293.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No