Information card for entry 4350312

Structure parameters

• Formula: C5 H14 F2 N O8 P2 V2
• Calculated formula: C5 H14 F2 N O8 P2 V2
• Title of publication: Evolution of the structural chemistry of vanadium organodiphosphonate networks and frameworks: structural consequences of fluoride incorporation in the development of stable phases with void channels.
• Authors of publication: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J; Zubieta, Jon
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7628 - 7641
• a: 7.5609 ± 0.0015 Å
• b: 14.189 ± 0.003 Å
• c: 11.174 ± 0.002 Å
• α: 90°
• β: 99.04 ± 0.03°
• γ: 90°
• Cell volume: 1183.9 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No