Information card for entry 2238865

Structure parameters

• Chemical name: Bis{4-[(<i>E</i>)-2-(1<i>H</i>-indol-3-yl)ethenyl]-1-methylpyridinium} 4-chlorobenzenesulfonate nitrate
• Formula: C38 H34 Cl N5 O6 S
• Calculated formula: C38 H34 Cl N5 O6 S
• Title of publication: Bis{4-[(<i>E</i>)-2-(1<i>H</i>-indol-3-yl)ethenyl]-1-methylpyridinium} 4-chlorobenzenesulfonate nitrate
• Authors of publication: Fun, Hoong-Kun; Quah, Ching Kheng; Boonnak, Nawong; Chantrapromma, Suchada
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 12
• Pages of publication: o1753 - o1754
• a: 8.754 ± 0.0007 Å
• b: 13.6648 ± 0.001 Å
• c: 15.3465 ± 0.0011 Å
• α: 97.206 ± 0.001°
• β: 91.186 ± 0.002°
• γ: 99.924 ± 0.001°
• Cell volume: 1792.3 ± 0.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0937
• Residual factor for significantly intense reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.2312
• Weighted residual factors for all reflections included in the refinement: 0.2541
• 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: No