Information card for entry 2241384

Structure parameters

• Chemical name: (<i>Z</i>)-3-Allyl-5-(4-chlorobenzylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
• Formula: C13 H10 Cl N O S2
• Calculated formula: C13 H10 Cl N O S2
• Title of publication: Crystal structure of (<i>Z</i>)-3-allyl-5-(4-chlorobenzylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
• Authors of publication: El Ajlaoui, Rahhal; Rakib, El Mostapha; Mojahidi, Souad; Saadi, Mohamed; El Ammari, Lahcen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: o1012
• a: 7.6197 ± 0.0008 Å
• b: 7.9849 ± 0.0007 Å
• c: 13.0624 ± 0.0014 Å
• α: 77.6 ± 0.005°
• β: 77.996 ± 0.005°
• γ: 61.954 ± 0.004°
• Cell volume: 679.76 ± 0.12 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0732
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1215
• Weighted residual factors for all reflections included in the refinement: 0.1438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes