Information card for entry 7030972

Structure parameters

• Formula: C51 H62 N8 O17 P2 V4
• Calculated formula: C51 H62 N8 O17 P2 V4
• Title of publication: Di-, tri- and tetranuclear molecular vanadium phosphonates: a chloride encapsulated tetranuclear bowl.
• Authors of publication: Sahoo, Dipankar; Suriyanarayanan, Ramakirushnan; Chandrasekhar, Vadapalli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 28
• Pages of publication: 10898 - 10909
• a: 9.765 ± 0.003 Å
• b: 12.448 ± 0.004 Å
• c: 14.734 ± 0.004 Å
• α: 66.947 ± 0.005°
• β: 84.914 ± 0.006°
• γ: 80.991 ± 0.005°
• Cell volume: 1626.9 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.1292
• Residual factor for significantly intense reflections: 0.0967
• Weighted residual factors for significantly intense reflections: 0.2693
• Weighted residual factors for all reflections included in the refinement: 0.3054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No