Information card for entry 1504355

Structure parameters

• Formula: C8 H11 F6 Li N2 O6 S2
• Calculated formula: C8 H11 F6 Li N2 O6 S2
• Title of publication: Cation-anion interactions in 1-ethyl-3-methylimidazolium trifluoromethanesulfonate-based ionic liquid electrolytes.
• Authors of publication: Burba, Christopher M.; Rocher, Nathalie M.; Frech, Roger; Powell, Douglas R.
• Journal of publication: The journal of physical chemistry. B
• Year of publication: 2008
• Journal volume: 112
• Journal issue: 10
• Pages of publication: 2991 - 2995
• a: 10.105 ± 0.003 Å
• b: 18.676 ± 0.005 Å
• c: 8.512 ± 0.002 Å
• α: 90°
• β: 94.012 ± 0.007°
• γ: 90°
• Cell volume: 1602.5 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1023
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1884
• Weighted residual factors for all reflections included in the refinement: 0.2041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No