Information card for entry 4504172

Structure parameters

• Formula: H60 K12 Ni7 O95 Si2 W16
• Calculated formula: K12 Ni7 O95 Si2 W16
• Title of publication: Synthesis, Characterization, and Crystal Structures of Double-Cubane-Substituted and Asymmetric Penta-Ni-Substituted Dimeric Polyoxometalates
• Authors of publication: Zhang, Zhiming; Wang, Enbo; Qi, Yanfei; Li, Yangguang; Mao, Baodong; Su, Zhongmin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 1305
• a: 11.442 ± 0.002 Å
• b: 11.905 ± 0.002 Å
• c: 17.169 ± 0.003 Å
• α: 107.62 ± 0.03°
• β: 91.67 ± 0.03°
• γ: 102.37 ± 0.03°
• Cell volume: 2166.1 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1562
• Residual factor for significantly intense reflections: 0.0865
• Weighted residual factors for significantly intense reflections: 0.1921
• Weighted residual factors for all reflections included in the refinement: 0.2339
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No