Information card for entry 7156401

Structure parameters

• Chemical name: N,2,4-Trimethylfuran-3-carboxamide
• Formula: C8 H11 N O2
• Calculated formula: C8 H11 N O2
• Title of publication: Silver(i)/base-promoted propargyl alcohol-controlled regio- or stereoselective synthesis of furan-3-carboxamides and (Z)-enaminones.
• Authors of publication: Sultana, Sabera; Shim, Jae-Jin; Kim, Sung Hong; Lee, Yong Rok
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 36
• Pages of publication: 6749 - 6759
• a: 5.0234 ± 0.0015 Å
• b: 12.137 ± 0.004 Å
• c: 13.751 ± 0.004 Å
• α: 90°
• β: 99.8 ± 0.02°
• γ: 90°
• Cell volume: 826.2 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0556
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No