Information card for entry 7103408

Structure parameters

• Formula: H52 Mo11 N7 O67 S V7
• Calculated formula: Mo11 N7 O67 S V7
• Title of publication: Solution identification and solid state characterisation of a heterometallic polyoxometalate {Mo(11)V(7)}: [Mo(VI)(11)V(V)(5)V(IV)(2)O(52)(mu(9)-SO(3))](7-).
• Authors of publication: Miras, Haralampos N; Stone, Daniel J; McInnes, Eric J L; Raptis, Raphael G; Baran, Peter; Chilas, George I; Sigalas, Michael P; Kabanos, Themistoklis A; Cronin, Leroy
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 39
• Pages of publication: 4703 - 4705
• a: 12.1402 ± 0.0002 Å
• b: 19.1486 ± 0.0003 Å
• c: 13.4922 ± 0.0003 Å
• α: 90°
• β: 105.653 ± 0.002°
• γ: 90°
• Cell volume: 3020.18 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0818
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No