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Bulletin of the Korean Chemical Society (BKCS)

ISSN 0253-2964(Print)
ISSN 1229-5949(Online)
Volume 25, Number 12
BKCSDE 25(12)
December 20, 2004 

 
Title
Single Organic Molecules Designed as Nanoscale Connectors: Fullerene Isoxazoline Derivatives
Author
Han Myong Lee, Changhoon Lee, Minsil Cho, Yong Gyoo Hwang, Kee Hag Lee*
Keywords
Regioisomers, Fullerene isoxazoline derivatives, Nanoscale connectors, PM3
Abstract
Recently a fullerene isoxazoline was reported as an example for nanoscale connectors in molecular electronic devices. The construction of nanoscale devices is a potentially important area of technology. By using the semiempirical PM3 calculation, we optimized the structures for two fullerene isoxazoline derivatives and thirteen regioisomers of the second addition of a nitride oxide to a fullerene isoxazoline derivative. Our results suggest that fullerene isoxazoline derivatives could be used as nanoscale connectors with the possibility of attaching of spacer units in a specific angle arrangement.
Page
1850 - 1854
Full Text
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