Information card for entry 2213754

Structure parameters

• Chemical name: 1,1'-(Butane-1,4-diyl)bis(imidazolium) bis(perchlorate)
• Formula: C10 H16 Cl2 N4 O8
• Calculated formula: C10 H16 Cl2 N4 O8
• SMILES: c1cn(c[nH+]1)CCCCn1cc[nH+]c1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: 1,1'-(Butane-1,4-diyl)bis(imidazolium) bis(perchlorate)
• Authors of publication: Jing-Cai Yao; Li Zhang; Li Qu; Cong Liu; Wei Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: o3029 - o3029
• a: 5.557 ± 0.001 Å
• b: 7.628 ± 0.0014 Å
• c: 9.6139 ± 0.0017 Å
• α: 95.273 ± 0.002°
• β: 96.074 ± 0.002°
• γ: 95.853 ± 0.002°
• Cell volume: 400.94 ± 0.13 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0369
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes