Information card for entry 8106750

Structure parameters

• Formula: C12 H20 F12 N4 P2
• Calculated formula: C12 H20 F12 N4 P2
• Title of publication: Crystal structure of 1,1′-butanebis(3-methyl-1H-imidazol-3-ium)bis(hexafluorophosphate), C12H20F12N4P2
• Authors of publication: Wan-Ming, Xiong; Jing, Chen; Da-Yong, Peng; Xu-Liang, Nie; Huang, Chang-gan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 6
• Pages of publication: 1007 - 1008
• a: 7.388 ± 0.004 Å
• b: 8.499 ± 0.004 Å
• c: 9.347 ± 0.004 Å
• α: 90.198 ± 0.005°
• β: 106.496 ± 0.005°
• γ: 113.042 ± 0.005°
• Cell volume: 513.5 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1938
• Weighted residual factors for all reflections included in the refinement: 0.2037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No