Information card for entry 4332479

Structure parameters

• Formula: Cs4 F6 Li2 Mo6 O24
• Calculated formula: Cs4 F6 Li2 Mo6 O24
• SMILES: [F]12[Mo]34(O[Mo]5([F]([Li]62[OH2])[Mo]2([F]7[Mo]8([F]6[Mo]6(O[Mo]1(=O)([F]61)(O3)=O)(O8)(=O)=O)(O2)(=O)=O)(O5)(=O)=O)([F]4[Li]71[OH2])(=O)=O)(=O)=O.O.O.[Cs+].[Cs+].[Cs+].[Cs+].O.O
• Title of publication: Synthesis and Characterization of Novel Fluorinated Poly(oxomolybdates)
• Authors of publication: Michailovski, Alexej; Rüegger, Heinz; Sheptyakov, Denis; Patzke, Greta R.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 5641 - 5652
• a: 8.0761 ± 0.0009 Å
• b: 10.2724 ± 0.0011 Å
• c: 10.4169 ± 0.0011 Å
• α: 109.632 ± 0.002°
• β: 92.343 ± 0.002°
• γ: 113.044 ± 0.002°
• Cell volume: 734.04 ± 0.14 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0468
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0754
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 0.82
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No