Information card for entry 2203251

Structure parameters

• Chemical name: Bis(3,5-dimethylpiperazinium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(III)] dihydrate
• Formula: C12 H38 Mo5 N4 O25 P2
• Calculated formula: C12 H38 Mo5 N4 O25 P2
• Title of publication: Bis(3,5-dimethylpiperazinium) di-μ~5~-hydrogenphosphato-penta-μ~2~-oxo-pentakis[dioxomolybdenum(V)] dihydrate
• Authors of publication: Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: m171 - m173
• a: 10.8677 ± 0.0005 Å
• b: 21.96 ± 0.001 Å
• c: 13.716 ± 0.0006 Å
• α: 90°
• β: 90.715 ± 0.001°
• γ: 90°
• Cell volume: 3273.1 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes