Information card for entry 7051602

Structure parameters

• Common name: ESLJP05
• Chemical name: ESLJP05
• Formula: C14 H15 F6 N3 O4 S2
• Calculated formula: C14 H15 F6 N3 O4 S2
• SMILES: S(=O)(=O)(C(F)(F)F)N=S([O-])(=O)C(F)(F)F.C(Cc1ccccc1)n1c[n+](cc1)C
• Title of publication: Electrochemical methodology for determination of imidazolium ionic liquids (solids at room temperature) properties: influence of the temperature
• Authors of publication: Stracke, M. P.; Migliorini, M. V.; Lissner, E.; Schrekker, H. S.; Back, D.; Lang, E. S.; Dupont, J.; Gonçalves, R. S.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 1
• Pages of publication: 82
• a: 9.7783 ± 0.0009 Å
• b: 15.2038 ± 0.0016 Å
• c: 12.8926 ± 0.0014 Å
• α: 90°
• β: 92.951 ± 0.006°
• γ: 90°
• Cell volume: 1914.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No