Information card for entry 2239736

Structure parameters

• Chemical name: 2,3-Diphenyl-1,3-thiazolidin-4-one
• Formula: C15 H13 N O S
• Calculated formula: C15 H13 N O S
• SMILES: C1(c2ccccc2)N(C(=O)CS1)c1ccccc1
• Title of publication: 2,3-Diphenyl-1,3-thiazolidin-4-one
• Authors of publication: Yennawar, Hemant P.; Tierney, John; Silverberg, Lee J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 8
• Pages of publication: o847
• a: 32.413 ± 0.013 Å
• b: 6.196 ± 0.003 Å
• c: 25.964 ± 0.011 Å
• α: 90°
• β: 100.258 ± 0.007°
• γ: 90°
• Cell volume: 5131 ± 4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1379
• Weighted residual factors for all reflections included in the refinement: 0.1466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes