Crystal structure, Hirshfeld surface analysis and DFT studies of N-(4-acetylphenyl)quinoline-3-carboxamide
Efraín Polo-Cuadrado, Karoll Ferrer, Edison Osorio, Iván Brito, Jonathan Cisterna, Margarita Gutiérrez
Topics & Concepts
ChemistryQuinolineMonoclinic crystal systemDensity functional theoryCrystal structureCrystallographyHydrogen bondCarboxamideCrystal (programming language)Single crystalProton NMRIntermolecular forceMoleculeComputational chemistryStereochemistryOrganic chemistryComputer scienceProgramming languageNonlinear Optical Materials ResearchCrystal structures of chemical compoundsSynthesis and biological activity