Information card for entry 4350315

Structure parameters

• Formula: C7 H31 F2 N3 O19.5 P4 V3.5
• Calculated formula: C7 H24 F2 N3 O19.5 P4 V3.5
• 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: 9.0982 ± 0.0005 Å
• b: 11.8549 ± 0.0006 Å
• c: 12.0113 ± 0.0007 Å
• α: 103.128 ± 0.001°
• β: 90.775 ± 0.001°
• γ: 91.887 ± 0.001°
• Cell volume: 1260.68 ± 0.12 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: 0.0563
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1211
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No