Study on crystal structure, spectroscopic, thermodynamic properties and Hirshfeld surfaces of a new spirocompound containing thiourea group C17H18N2O4S
Wu-Lan Zeng, Xia Wang, Xiangjun Kong, Youwang Li, Yunju Zhang
Topics & Concepts
ChemistryNatural bond orbitalThioureaMulliken population analysisRaman spectroscopyHOMO/LUMOCrystallographyInfrared spectroscopyCarbon-13 NMRChemical shiftSingle crystalPhysical chemistryComputational chemistryDensity functional theoryStereochemistryMoleculeOrganic chemistryOpticsPhysicsSynthesis and biological activityOrganic Chemistry Cycloaddition ReactionsFree Radicals and Antioxidants