Information card for entry 2224243

Structure parameters

• Chemical name: 3-(3-Methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
• Formula: C10 H9 N O S2
• Calculated formula: C10 H9 N O S2
• Title of publication: 3-(3-Methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
• Authors of publication: Shahwar, Durre; Tahir, M. Nawaz; Yasmeen, Asma; Ahmad, Naeem; Khan, Muhammad Akmal
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o3016
• a: 8.0775 ± 0.0003 Å
• b: 6.4058 ± 0.0002 Å
• c: 21.4715 ± 0.0007 Å
• α: 90°
• β: 106.068 ± 0.002°
• γ: 90°
• Cell volume: 1067.59 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0451
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes