Information card for entry 8105425

Structure parameters

• Chemical name: 3,3'-(1,2-phenylenebis(methylene))bis(1-methyl- 1H-imidazol-3-ium) bis(hexafluoro phosphate)(V)
• Formula: C16 H20 F12 N4 P2
• Calculated formula: C16 H20 F12 N4 P2
• Title of publication: Crystal structure of 3,3′-(1,2-phenylenebis(methylene))bis(1-methyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C16H20F12N4P2
• Authors of publication: Yao-Hong, Zhou; Ting, Huang; Xu-Liang, Nie; Jing, Chen; Wan-Ming, Xiong
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 5
• Pages of publication: 1217 - 1219
• a: 7.3086 ± 0.0015 Å
• b: 12.174 ± 0.003 Å
• c: 26.355 ± 0.006 Å
• α: 90°
• β: 94.5 ± 0.002°
• γ: 90°
• Cell volume: 2337.7 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0915
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.2081
• Weighted residual factors for all reflections included in the refinement: 0.2262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No