Information card for entry 7212785

Structure parameters

• Common name: 1,3-dihexyl-benzimidazolium hexaflorophosphate
• Formula: C19 H31 F6 N2 P
• Calculated formula: C19 H31 F6 N2 P
• Title of publication: N,N′-Dihexylbenzimidazolium salts. Anion-controlled bilayer structures viaπ‒π dimer or C‒H⋯π catemer motifs
• Authors of publication: Lee, Kwang-Ming; Lee, Ching-Kuan; Lin, Ivan J. B.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 4347
• a: 8.5636 ± 0.0015 Å
• b: 9.392 ± 0.006 Å
• c: 28.1899 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2267.3 ± 1.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1643
• Residual factor for significantly intense reflections: 0.0829
• Weighted residual factors for significantly intense reflections: 0.1889
• Weighted residual factors for all reflections included in the refinement: 0.247
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No