Information card for entry 4114484

Structure parameters

• Formula: C54 H108 N9 Na Os Re5 Se8
• Calculated formula: C38 H72 N8 Na Os1.02 Re4.98 Se8
• Title of publication: Cluster-to-Metal Magnetic Coupling: Synthesis and Characterization of 25-Electron [Re6-nOsnSe8(CN)6](5-n)- (n = 1, 2) Clusters and {Re6-nOsnSe8[CNCu(Me6tren)]6}9+ (n = 0, 1, 2) Assemblies
• Authors of publication: Eric G. Tulsky; Nathan R. M. Crawford; Stéphane A. Baudron; Patrick Batail; Jeffrey R. Long
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 15543 - 15553
• a: 15.1987 ± 0.0011 Å
• b: 20.0425 ± 0.0003 Å
• c: 15.5439 ± 0.0009 Å
• α: 90°
• β: 113.895 ± 0.005°
• γ: 90°
• Cell volume: 4329.1 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1868
• Residual factor for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections: 0.2763
• Weighted residual factors for significantly intense reflections: 0.2163
• Goodness-of-fit parameter for all reflections: 1.014
• Goodness-of-fit parameter for significantly intense reflections: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No