Information card for entry 2016500

Structure parameters

• Chemical name: calcium pentamolybdenum titanium decaoxide
• Formula: Ca Mo5.38 O10 Ti0.62
• Calculated formula: Ca Mo5.382 O10 Ti0.618
• Title of publication: The disordered cluster compound CaMo~5~(Mo~0.38~Ti~0.62~)O~10~
• Authors of publication: Gougeon, P.; Gall, P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: i30 - i32
• a: 8.9779 ± 0.0001 Å
• b: 11.4442 ± 0.0002 Å
• c: 15.0673 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1548.09 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.0568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes