Information card for entry 4335583

Structure parameters

• Chemical name: Pentaoxo-difluorido[1,3-bis(1,2,4-triazol-4-yl)propane] dimolybdenum(VI)
• Formula: C7 H10 F2 Mo2 N6 O5
• Calculated formula: C7 H10 F2 Mo2 N6 O5
• Title of publication: Unprecedented Trapping of Difluorooctamolybdate Anions within an α-Polonium Type Coordination Network
• Authors of publication: Olena V. Sharga; Andrey B. Lysenko; Marcel Handke; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Karl W. Krämer; Shi-Xia Liu; Silvio Decurtins; Adam Bridgeman; Konstantin V. Domasevitch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8784 - 8794
• a: 10.7334 ± 0.0011 Å
• b: 11.8312 ± 0.0011 Å
• c: 5.5037 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 698.91 ± 0.12 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n :2
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0548
• Weighted residual factors for all reflections included in the refinement: 0.0576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No