Information card for entry 4319137

Structure parameters

• Formula: C48 H108 Mo12 N3 O40 S
• Calculated formula: C48 Mo12 N3 O40 S
• Title of publication: Electrochemical Synthesis and Structural and Physical Characterization of One- and Two-Electron-Reduced Forms of [SMo12O40]2-
• Authors of publication: Truc Vu; Alan M. Bond; David C. R. Hockless; Boujemaa Moubaraki; Keith S. Murray; Georgii Lazarev; Anthony G. Wedd
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 65 - 72
• a: 13.84 ± 0.003 Å
• b: 15.587 ± 0.004 Å
• c: 19.37 ± 0.003 Å
• α: 94.86 ± 0.02°
• β: 93.1 ± 0.01°
• γ: 91.05 ± 0.02°
• Cell volume: 4156.4 ± 1.5 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 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 significantly intense reflections: 0.0639
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 2.684
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No