Information card for entry 7104438

Structure parameters

• Formula: C21 H17 F10 N3
• Calculated formula: C21 H17 F10 N3
• SMILES: c1(c(c(c(c(c1F)F)F)F)F)[N-]c1c(c(c(c(c1F)F)F)F)F.CC(C)n1c[n+](C(C)C)cc1
• Title of publication: Three novel anions based on pentafluorophenyl amine combined with two new synthetic strategies for the synthesis of highly lipophilic ionic liquids.
• Authors of publication: Linder, Thomas; Sundermeyer, Jörg
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 20
• Pages of publication: 2914 - 2916
• a: 14.167 ± 0.0016 Å
• b: 11.029 ± 0.001 Å
• c: 13.616 ± 0.0014 Å
• α: 90°
• β: 91.068 ± 0.001°
• γ: 90°
• Cell volume: 2127.1 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0969
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No