Information card for entry 2224314

Structure parameters

• Chemical name: (2<i>Z</i>)-2-Fluoro-<i>N</i>-{4-[5-(4-fluorophenyl)-2-methylsulfanyl- 1<i>H</i>-imidazol-4-yl]-2-pyridyl}-3-phenylacrylamide
• Formula: C24 H18 F2 N4 O S
• Calculated formula: C24 H18 F2 N4 O S
• Title of publication: (2<i>Z</i>)-2-Fluoro-<i>N</i>-{4-[5-(4-fluorophenyl)-2-methylsulfanyl-1<i>H</i>-imidazol-4-yl]-2-pyridyl}-3-phenylacrylamide
• Authors of publication: Selig, Roland; Schollmeyer, Dieter; Stegmiller, Thomas; Albrecht, Wolfgang; Laufer, Stefan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o3284
• a: 20.637 ± 0.001 Å
• b: 7.8413 ± 0.0005 Å
• c: 26.256 ± 0.002 Å
• α: 90°
• β: 93.456 ± 0.004°
• γ: 90°
• Cell volume: 4241 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1261
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes