Information card for entry 2225901

Structure parameters

• Chemical name: 2-(4-Fluorophenyl)-<i>N</i>-{4-[6-(4-fluorophenyl)-2,3- dihydroimidazo[2,1-<i>b</i>][1,3]thiazol-5-yl]pyridin-2-yl}acetamide
• Formula: C24 H18 F2 N4 O S
• Calculated formula: C24 H18 F2 N4 O S
• SMILES: Fc1ccc(cc1)CC(=O)Nc1nccc(c1)c1c(nc2n1CCS2)c1ccc(cc1)F
• Title of publication: 2-(4-Fluorophenyl)-<i>N</i>-{4-[6-(4-fluorophenyl)-2,3-dihydroimidazo[2,1-<i>b</i>][1,3]thiazol-5-yl]pyridin-2-yl}acetamide
• Authors of publication: Selig, Roland; Schollmeyer, Dieter; Albrecht, Wolfgang; Laufer, Stefan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: o1132
• a: 4.9179 ± 0.0003 Å
• b: 23.592 ± 0.001 Å
• c: 18.4834 ± 0.0009 Å
• α: 90°
• β: 91.523 ± 0.002°
• γ: 90°
• Cell volume: 2143.74 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.0903
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes