Information card for entry 7028218

Structure parameters

• Formula: C7 H7 F3 N2 O V
• Calculated formula: C7 H7 F3 N2 O V
• Title of publication: Structural diversity in hybrid vanadium(IV) oxyfluorides based on a common building block.
• Authors of publication: Aidoudi, Farida H.; Black, Cameron; Arachchige, Kasun S Athukorala; Slawin, Alexandra M. Z.; Morris, Russell E.; Lightfoot, Philip
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 568 - 575
• a: 24.5014 ± 0.001 Å
• b: 3.8344 ± 0.0013 Å
• c: 18.979 ± 0.007 Å
• α: 90°
• β: 105.454 ± 0.007°
• γ: 90°
• Cell volume: 1718.6 ± 0.9 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for significantly intense reflections: 0.208
• Weighted residual factors for all reflections included in the refinement: 0.2644
• Goodness-of-fit parameter for all reflections included in the refinement: 1.276
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No