Information card for entry 4339441

Structure parameters

• Formula: Cu14 H77 Na16 O164.5 Si4 W32
• Calculated formula: Cu14 Na15 O164.5 Si4 W32
• Title of publication: Two multi-copper-containing heteropolyoxotungstates constructed from the lacunary Keggin polyoxoanion and the high-nuclear spin cluster.
• Authors of publication: Zhang, Zhiming; Qi, Yanfei; Qin, Chao; Li, Yangguang; Wang, Enbo; Wang, Xinlong; Su, Zhongmin; Xu, Lin
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 20
• Pages of publication: 8162 - 8169
• a: 27.629 ± 0.006 Å
• b: 22.898 ± 0.005 Å
• c: 16.095 ± 0.003 Å
• α: 90°
• β: 113.65 ± 0.03°
• γ: 90°
• Cell volume: 9327 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1066
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No