Information card for entry 4513626

Structure parameters

• Formula: C16 H14 F12 N4 O8 S4
• Calculated formula: C16 H14 F12 N4 O8 S4
• SMILES: S(=O)([O-])(=NS(=O)(=O)C(F)(F)F)C(F)(F)F.S(=O)([O-])(=NS(=O)(=O)C(F)(F)F)C(F)(F)F.[n+]1(ccc(cc1)c1cc[n+](cc1)C)C
• Title of publication: A Dialkyl Viologen Ionic Liquid: X-ray Crystal Structure Analysis of Bis(trifluoromethanesulfonyl)imide Salts
• Authors of publication: Tahara, Hironobu; Furue, Yutaro; Suenaga, Chie; Sagara, Takamasa
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 10
• Pages of publication: 4735
• a: 9.049 ± 0.003 Å
• b: 11.126 ± 0.003 Å
• c: 14.542 ± 0.003 Å
• α: 67.951 ± 0.01°
• β: 77.3 ± 0.013°
• γ: 81.602 ± 0.013°
• Cell volume: 1320.5 ± 0.6 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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 significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No