Information card for entry 4326897

Structure parameters

• Formula: C20 H70 Mo6 N20 O40 P4
• Calculated formula: C18 H36 Mo6 N14 O35.25 P4
• 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: 11.2994 ± 0.0004 Å
• b: 12.5679 ± 0.0004 Å
• c: 19.8205 ± 0.0006 Å
• α: 81.723 ± 0.002°
• β: 79.307 ± 0.002°
• γ: 78.468 ± 0.002°
• Cell volume: 2693.25 ± 0.15 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: 0.0692
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.1579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No