Information card for entry 2230360

Structure parameters

• Chemical name: Tris(morpholinium) hexa-μ~3~-hydroxido-hexa-μ~2~-oxido- dodecaoxidohexamolybdenum(VI)chromate(III) tetrahydrate
• Formula: C12 H44 Cr Mo6 N3 O31
• Calculated formula: C12 H44 Cr Mo6 N3 O31
• Title of publication: Tris(morpholinium) hexa-μ~3~-hydroxido-hexa-μ~2~-oxido-dodecaoxidohexamolybdenum(VI)chromate(III) tetrahydrate
• Authors of publication: Yang, Yan-Yan; Song, Yu; Liu, Li-Ye; Qu, Xiao-Shu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m776
• a: 7.9474 ± 0.0004 Å
• b: 9.9654 ± 0.0005 Å
• c: 13.7404 ± 0.0007 Å
• α: 110.392 ± 0.001°
• β: 102.921 ± 0.001°
• γ: 90.635 ± 0.001°
• Cell volume: 989.47 ± 0.09 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0287
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes