Information card for entry 2200108

Structure parameters

• Formula: C4 H4 Mo2 N2 O6
• Calculated formula: C4 H4 Mo2 N2 O6
• Title of publication: Polymeric tri-μ-oxo(pyrazine)molybdenum(VI)
• Authors of publication: Liang, Yucang; Hong, Maochun; Cao, Rong; Sun, Daofeng; Weng, Jiabao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 4
• Pages of publication: m159 - m161
• a: 7.566 ± 0.016 Å
• b: 7.39 ± 0.02 Å
• c: 14.04 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 785 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for all reflections included in the refinement: 0.0856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.238
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No