Information card for entry 2212286

Structure parameters

• Common name: 2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate
• Chemical name: 2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate
• Formula: C21 H20 Cl N O4 S
• Calculated formula: C21 H20 Cl N O4 S
• Title of publication: 2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate
• Authors of publication: Suchada Chantrapromma; Thitipone Suwanwong; Hoong-Kun Fun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: o821 - o823
• a: 15.2016 ± 0.0005 Å
• b: 13.7923 ± 0.0004 Å
• c: 22.0003 ± 0.0007 Å
• α: 90°
• β: 123.274 ± 0.002°
• γ: 90°
• Cell volume: 3856.5 ± 0.2 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1818
• Weighted residual factors for all reflections included in the refinement: 0.2004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes