Information card for entry 4108647

Structure parameters

• Formula: H96 K20 O200 P4 W44
• Calculated formula: K20 O196.9 P4 W44
• Title of publication: "Bottom-Up" Meets "Top-Down" Assembly in Nanoscale Polyoxometalate Clusters: Self-Assembly of [P4W52O178]24- and Disassembly to [P3W39O134]19-
• Authors of publication: Chullikkattil P. Pradeep; De-Liang Long; Carsten Streb; Leroy Cronin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 14946 - 14947
• a: 18.8407 ± 0.0005 Å
• b: 19.7247 ± 0.0007 Å
• c: 29.5038 ± 0.0008 Å
• α: 76.332 ± 0.002°
• β: 88.495 ± 0.002°
• γ: 65.954 ± 0.003°
• Cell volume: 9699 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.054
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No