Information card for entry 4319747

Structure parameters

• Formula: As4 Ba Ce4 Cl H65 Na16 O206 W40
• Calculated formula: As4 Ba Ce4 Cl0.75 Na9.65 O205.8 W40
• Title of publication: Large Cluster Formation through Multiple Substitution with Lanthanide Cations (La, Ce, Nd, Sm, Eu, and Gd) of the Polyoxoanion [(B-α-AsO3W9O30)4(WO2)4]28-. Synthesis and Structural Characterization
• Authors of publication: Knut Wassermann; Michael T. Pope
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 2763 - 2768
• a: 21.101 ± 0.003 Å
• b: 21.339 ± 0.003 Å
• c: 26.127 ± 0.003 Å
• α: 85.477 ± 0.002°
• β: 68.241 ± 0.002°
• γ: 84.033 ± 0.002°
• Cell volume: 10857 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1573
• Residual factor for significantly intense reflections: 0.0711
• Weighted residual factors for significantly intense reflections: 0.1637
• Weighted residual factors for all reflections included in the refinement: 0.2044
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No