Information card for entry 8105796

Structure parameters

• Formula: C16 H28 F12 N4 P2
• Calculated formula: C16 H28 F12 N4 P2
• Title of publication: Crystal structure of 1,1′-(hexane-1,6-diyl)bis(3-ethyl-1H-imidazol-3-ium) bis(hexafluorido phosphate), C16H28F12N4P2
• Authors of publication: Wen, Zhao; Jing, Chen; Wan-Ming, Xiong; Ying-Dong, Lan; Xu-Liang, Nie
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 4
• Pages of publication: 609 - 611
• a: 8.7921 ± 0.0012 Å
• b: 16.173 ± 0.002 Å
• c: 9.1376 ± 0.0012 Å
• α: 90°
• β: 111.236 ± 0.001°
• γ: 90°
• Cell volume: 1211.1 ± 0.3 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1197
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No