Information card for entry 4350314

Structure parameters

• Formula: C9.5 H28 F6 N2 O10 P3 V3
• Calculated formula: C9.5 H28 F6 N2 O10 P3 V3
• 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: 7.8942 ± 0.0008 Å
• b: 9.3578 ± 0.0009 Å
• c: 17.2016 ± 0.0017 Å
• α: 99.665 ± 0.002°
• β: 96.062 ± 0.002°
• γ: 107.762 ± 0.002°
• Cell volume: 1176.2 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0753
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1294
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No