Information card for entry 4318260

Structure parameters

• Common name: piperazine polyoxomolybdenum phosphonate
• Formula: C19 H54 Mo7 N8 O42 P6
• Calculated formula: C19 H54 Mo7 N8 O42 P6
• Title of publication: Synthesis and Characterization of [Mo7O16(O3PCH2PO3)3]8-: A Mixed-Valent Polyoxomolybdenum Diphosphonate Anion with Octahedrally and Tetrahedrally Coordinated Molybdenum
• Authors of publication: Eddy Dumas; Capucine Sassoye; Kristin D. Smith; Slavi C. Sevov
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4029 - 4032
• a: 13.255 ± 0.002 Å
• b: 13.638 ± 0.002 Å
• c: 16.874 ± 0.004 Å
• α: 93.2 ± 0.02°
• β: 101.27 ± 0.02°
• γ: 105.87 ± 0.01°
• Cell volume: 2858.1 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0325
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for all reflections: 0.0695
• Weighted residual factors for significantly intense reflections: 0.0654
• Goodness-of-fit parameter for all reflections: 1.062
• Goodness-of-fit parameter for significantly intense reflections: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No