Information card for entry 7015601

Structure parameters

• Formula: C2 H14 F4 N2 O2 V
• Calculated formula: C2 H14 F4 N2 O2 V
• SMILES: [NH3+]C.C[NH3+].F[V]([OH2])(F)(F)(F)=O
• Title of publication: Ionic liquids and deep eutectic mixtures as new solvents for the synthesis of vanadium fluorides and oxyfluorides.
• Authors of publication: Aidoudi, Farida H.; Byrne, Peter J.; Allan, Pheobe K.; Teat, Simon J.; Lightfoot, Philip; Morris, Russell E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 16
• Pages of publication: 4324 - 4331
• a: 6.932 ± 0.006 Å
• b: 7.822 ± 0.006 Å
• c: 8.129 ± 0.001 Å
• α: 110.32 ± 0.03°
• β: 90.12 ± 0.03°
• γ: 90.95 ± 0.02°
• Cell volume: 413.3 ± 0.5 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 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: 0.0949
• Residual factor for significantly intense reflections: 0.0897
• Weighted residual factors for significantly intense reflections: 0.1916
• Weighted residual factors for all reflections included in the refinement: 0.1972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.193
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No