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Bond length calculation of aniline and its reaction products by semi-empirical method
International Journal of Advanced Academic Studies · 2019 · Vol. 1(2) · pp. 138–140
Amrendra Kumar Singh✉(Ganesh Shankar Vidyarthi Memorial Medical College)
Abstract
A semi-empirical molecular orbital method MINOD/3 is used to evaluate the bond length of aniline, and its reaction product like diphenyl urea, acetanilide and benzanilide. The results obtained are in good agreement with experimental result.
Organic Chemistry Cycloaddition ReactionsChemical Thermodynamics and Molecular StructureAnalytical Chemistry and ChromatographyAcetanilideAnilineBond lengthMolecular orbitalComputational chemistryBondProduct (mathematics)ChemistryMaterials scienceMathematics
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