Information card for entry 4317005

Structure parameters

• Formula: C20 H36 Cu4 N32 O42 S8 Si W12
• Calculated formula: C20 H32 Cu4 N32 O42 S8 Si W12
• Title of publication: Application of Tetrazole-Functionalized Thioethers with Different Spacer Lengths in the Self-Assembly of Polyoxometalate-Based Hybrid Compounds
• Authors of publication: Xiuli Wang; Hailiang Hu; Aixiang Tian; Hongyan Lin; Jin Li
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 10299 - 10306
• a: 12.3635 ± 0.0013 Å
• b: 13.2905 ± 0.0014 Å
• c: 13.905 ± 0.0015 Å
• α: 88.053 ± 0.002°
• β: 68.583 ± 0.001°
• γ: 64.326 ± 0.001°
• Cell volume: 1895.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1249
• Residual factor for significantly intense reflections: 0.1182
• Weighted residual factors for significantly intense reflections: 0.2767
• Weighted residual factors for all reflections included in the refinement: 0.279
• Goodness-of-fit parameter for all reflections included in the refinement: 1.371
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No