Information card for entry 2237510

Structure parameters

• Chemical name: (<i>E</i>)-2-[4-(Diethylamino)styryl]-1-ethylpyridinium iodide monohydrate
• Formula: C19 H27 I N2 O
• Calculated formula: C19 H27 I N2 O
• Title of publication: (<i>E</i>)-2-[4-(Diethylamino)styryl]-1-ethylpyridinium iodide monohydrate
• Authors of publication: Chantrapromma, Suchada; Boonnak, Nawong; Kaewmanee, Narissara; Quah, Ching Kheng; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 3
• Pages of publication: o458 - o459
• a: 7.9969 ± 0.0001 Å
• b: 9.1336 ± 0.0001 Å
• c: 14.774 ± 0.0002 Å
• α: 96.22 ± 0.001°
• β: 105.43 ± 0.001°
• γ: 105.06 ± 0.001°
• Cell volume: 986.05 ± 0.02 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0302
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0528
• Weighted residual factors for all reflections included in the refinement: 0.0548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes