Information card for entry 7003208

Structure parameters

• Formula: H34 N2 Na4 O74 V3 W17
• Calculated formula: N2 Na4 O73.7333 V3.08 W16.92
• Title of publication: Bridging the gap between solution and solid state studies in polyoxometalate chemistry: Discovery of a family of [V1M17]-based cages encapsulating two {VVO4} moieties
• Authors of publication: Miras, Haralampos N.; Long, De-Liang; Kögerler, Paul; Cronin, Leroy
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 2
• Pages of publication: 214 - 221
• a: 37.655 ± 0.003 Å
• b: 37.655 ± 0.003 Å
• c: 13.0008 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 15964 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :H
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No