Information card for entry 4035515

Structure parameters

• Formula: C24 H20 N2
• Calculated formula: C24 H20 N2
• SMILES: c1(cc(c(c(n1)Nc1ccccc1)C)c1ccccc1)c1ccccc1
• Title of publication: Synthesis of 2-Aminopyridines via a Base-Promoted Cascade Reaction of N-Propargylic β-Enaminones with Formamides.
• Authors of publication: Weng, Yunxiang; Kuai, Changsheng; Lv, Weiwei; Cheng, Guolin
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2018
• Journal volume: 83
• Journal issue: 9
• Pages of publication: 5002 - 5008
• a: 10.53852 ± 0.00015 Å
• b: 11.82433 ± 0.00016 Å
• c: 14.4092 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1795.54 ± 0.04 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0841
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No