Information card for entry 4326898

Structure parameters

• Formula: C32 H72 Mo8 N16 Na8 O56 P8
• Calculated formula: C36 H72 Mo8 N28 Na6 O65 P8
• Title of publication: Polyoxomolybdodiphosphonates: Examples Incorporating Ethylidenepyridines
• Authors of publication: Abhishek Banerjee; Farah S. Raad; Nina Vankova; Bassem S. Bassil; Thomas Heine; Ulrich Kortz
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 11667 - 11675
• a: 25.3368 ± 0.0011 Å
• b: 25.3368 ± 0.0011 Å
• c: 8.0896 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5193.1 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1472
• Weighted residual factors for all reflections included in the refinement: 0.1771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No