Information card for entry 2225130

Structure parameters

• Chemical name: Tris{aquabis[3-(2-pyridyl)-1<i>H</i>-pyrazole]copper(II)} di-μ~9~-arsenato-hexatriaconta-μ~2~-oxido-octadecaoxidooctadecamolybdate(VI)
• Formula: C48 H48 As2 Cu3 Mo18 N18 O65
• Calculated formula: C48 H48 As2 Cu3 Mo18 N18 O65
• Title of publication: Tris{aquabis[3-(2-pyridyl)-1<i>H</i>-pyrazole]copper(II)} di-μ~9~-arsenato-hexatriaconta-μ~2~-oxido-octadecaoxidooctadecamolybdate(VI)
• Authors of publication: Zhang, Xiutang; Wei, Peihai; Shi, Congwen; Li, Bin; Hu, Bo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: m174 - m175
• a: 21.967 ± 0.003 Å
• b: 21.967 ± 0.003 Å
• c: 34.411 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 14380 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1099
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes