Information card for entry 2205143

Structure parameters

• Chemical name: (Z)-1-phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone
• Formula: C17 H15 N O S
• Calculated formula: C17 H15 N O S
• SMILES: S1CCN(C\1=C\C(=O)c1ccccc1)c1ccccc1
• Title of publication: (<i>Z</i>)-1-Phenyl-2-(3-phenylthiazolidin-2-ylidene)ethanone
• Authors of publication: Liang-zhong Xu; Hai-Zhen Xu; Hai-Bin Song; Yong-Qi Qin; Kai Zhou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 2
• Pages of publication: o459 - o460
• a: 9.5998 ± 0.0012 Å
• b: 10.8872 ± 0.0013 Å
• c: 14.4903 ± 0.0018 Å
• α: 79.303 ± 0.002°
• β: 76.243 ± 0.002°
• γ: 80.467 ± 0.002°
• Cell volume: 1433.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0506
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0874
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes