Information card for entry 2231692

Structure parameters

• Chemical name: 3-benzyl-1-({4-[(3-benzyl-1H-imidazol-3-ium-1-yl)methyl]naphthalen- 1-yl}methyl)-1H-imidazol-3-ium bis(hexafluorophosphate)
• Formula: C32 H30 F12 N4 P2
• Calculated formula: C32 H30 F12 N4 P2
• Title of publication: 3,3'-Dibenzyl-1,1'-[naphthalene-1,4-diylbis(methylene)]di(1<i>H</i>-imidazol-3-ium) bis(hexafluorophosphate)
• Authors of publication: Liu, Chang-Lu; Huang, Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2343
• a: 33.825 ± 0.0009 Å
• b: 11.6062 ± 0.0003 Å
• c: 17.6986 ± 0.0005 Å
• α: 90°
• β: 101.158 ± 0.001°
• γ: 90°
• Cell volume: 6816.8 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0812
• Residual factor for significantly intense reflections: 0.0665
• Weighted residual factors for significantly intense reflections: 0.1543
• Weighted residual factors for all reflections included in the refinement: 0.1631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes