%0 Journal Article %T Theoretical Study of the Properties of Adenine Amino Acid Tetomers with C60 %J International Journal of New Chemistry %I Iranian Chemical Science and Technologies Association %Z 2645-7237 %A Moghadasi, Saeedeh %D 2016 %\ 08/01/2016 %V 3 %N 3 %P 69-73 %! Theoretical Study of the Properties of Adenine Amino Acid Tetomers with C60 %K adenine %K Fullerenes %K NBO %K NMR %K IR %R 10.22034/ijnc.2016.34986 %X In this research at the Adenine tautomers and their fullerene derivatives were optimized. NBO calculations and NMR for the tautomers and their Fullerene derivatives were carried out at the B3lyp/6-31G*quantum chemistry level. The core and the valence electrons of atoms were compared. Other cases examined in this study, resonance energy, chemical potential (µ ), chemical hardness (η) , Energy Gap, Chemical Hardness, Chemical Potential, Dipole moment parameters between Adenine tautomers and their fullerene derivatives were calculated .This organic base as a chemical component of DNA and RNA plays an important role in our body. In this study of fullerenes, we used a nano carrier. The data in tables and graphs and shapes were compared and discussed. %U https://www.ijnc.ir/article_34986_31e4aa81b0c57e942545739ed7c8fce4.pdf