Information card for entry 7053739

Structure parameters

• Common name: 1-Ethyl-3-(trifluoromethyl)pyridinium bis((trifluoromethyl)sulfonyl)amide
• Chemical name: 1-Ethyl-3-(trifluoromethyl)pyridinium bis{(trifluoromethyl)sulfonyl}amide
• Formula: C10 H9 F9 N2 O4 S2
• Calculated formula: C9.752 H9 F8.256 N2 O4 S2
• Title of publication: Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts
• Authors of publication: Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2008
• Journal volume: 32
• Journal issue: 11
• Pages of publication: 1953
• a: 10.8446 ± 0.0015 Å
• b: 12.866 ± 0.002 Å
• c: 13.2369 ± 0.0019 Å
• α: 90.366 ± 0.005°
• β: 90.689 ± 0.004°
• γ: 114.836 ± 0.003°
• Cell volume: 1675.8 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.1033
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.2184
• Weighted residual factors for all reflections included in the refinement: 0.2397
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotronradiation
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No