Information card for entry 2206171

Structure parameters

• Chemical name: 2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
• Formula: C22 H19 N O2 S
• Calculated formula: C22 H19 N O2 S
• SMILES: S1C(N(C(=O)C1)c1ccc(OC)cc1)c1ccc(c2ccccc2)cc1
• Title of publication: 2-(Biphenyl-4-yl)-3-(4-methoxyphenyl)-1,3-thiazolidin-4-one
• Authors of publication: Mahendra, M; Jayalakshmi, K.; Basappa; Rangappa, K. S.; Sridhar, M. A.; Shashidhara Prasad, J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 7
• Pages of publication: o2315 - o2317
• a: 6.287 ± 0.0005 Å
• b: 13.248 ± 0.0009 Å
• c: 22.25 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1853.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P b c 21
• Hall space group symbol: P 2c -2b
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes