Information card for entry 4340199

Structure parameters

• Formula: Ga H18.6 K2 Na3 O49.3 W12
• Calculated formula: Ga K2 Na3 O49.3 W12
• Title of publication: Relative energies of alpha and beta isomers of Keggin dodecatungstogallate.
• Authors of publication: Sundaram, Karthik M.; Neiwert, Wade A.; Hill, Craig L.; Weinstock, Ira A.
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 3
• Pages of publication: 958 - 960
• a: 18.9201 ± 0.0013 Å
• b: 18.9201 ± 0.0013 Å
• c: 12.5108 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3878.5 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 154
• Hermann-Mauguin space group symbol: P 32 2 1
• Hall space group symbol: P 32 2"
• Residual factor for all reflections: 0.0434
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0917
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No