Quantum Chemistry Studies on Reactivity of the 2-Amino-3-(3,4-Dihydroxyphenyl)Propanoic Acid Drug Linked to to C60

Quantum Chemistry Studies on Reactivity of the 2-Amino-3-(3,4-Dihydroxyphenyl)Propanoic Acid Drug Linked to to C60

In this research at the first 2-amino-3-(3,4-dihydroxyphenyl) propanoic aciddrug drug and its fullerene derivative were optimized. NBO calculations and NMR for the complexes were carried out at the B3LYP/6-31G*quantum chemistry level. Different parameters such as energy levels, the amount of Chemic...

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Bibliographic Details
Main Author:	Marjan Firoozeh 
Format:	Article
Language:	English
Published:	Iranian Chemical Science and Technologies Association 2016-06-01
Series:	International Journal of New Chemistry
Subjects:	2-amino-3-(3 ; 4-dihydroxyphenyl)propanoic aciddrug ; fullerenes ; chemical potential ; nano drug carriers
Online Access:	http://www.ijnc.ir/article_34982.html

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