Information card for entry 2201368

Structure parameters

• Chemical name: 4-(N,N-dimethylaminomethylene)-2-phenyl-2-oxazolin-5-one
• Formula: C12 H12 N2 O2
• Calculated formula: C12 H12 N2 O2
• Title of publication: 4-(<i>N,N</i>-Dimethylaminomethylene)-2-phenyl-2-oxazolin-5-one
• Authors of publication: Vasuki, G.; Thamotharan, S.; Ramamurthi, K.; Ambika, S.; Singh, R. M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 7
• Pages of publication: o740 - o741
• a: 8.416 ± 0.006 Å
• b: 11.288 ± 0.003 Å
• c: 12.097 ± 0.003 Å
• α: 85.39 ± 0.03°
• β: 73.97 ± 0.04°
• γ: 83.31 ± 0.04°
• Cell volume: 1095.6 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.136
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes