Information card for entry 2227166

Structure parameters

• Chemical name: Bis[2-(2-pyridylsulfanyl)ethyl]ammonium perchlorate
• Formula: C14 H18 Cl N3 O4 S2
• Calculated formula: C14 H18 Cl N3 O4 S2
• Title of publication: Bis[2-(2-pyridylsulfanyl)ethyl]ammonium perchlorate
• Authors of publication: Wang, Guo-Qing; Ma, Cong-Hui; Li, Xiao-Feng; Li, Wen-Ge; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: o2335
• a: 8.1265 ± 0.0006 Å
• b: 9.2291 ± 0.0007 Å
• c: 11.9872 ± 0.0009 Å
• α: 90°
• β: 97.534 ± 0.007°
• γ: 90°
• Cell volume: 891.28 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.2058
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes