| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5383985 | Chemical Physics Letters | 2011 | 5 Pages |
Abstract
⺠The [2]-rotaxane formation has beneficial effects on solubility and thermal properties. ⺠HyperChem followed by theoretical PM3 method confirms the synthesis of [2]-rotaxane. ⺠The cavity of α-CD is large enough to fully accommodate inside the triazole molecule. ⺠Semi-empirical PM3 method indicates the desired blocking effect of pyrene molecules. ⺠PM3 calculations give results which coincide with the experimental findings.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
![Thermal analysis and theoretical study of α-cyclodextrin azomethine [2]-rotaxane formation by semi-empirical method PM3](/preview/png/5383985.png "First Page Preview: Thermal analysis and theoretical study of α-cyclodextrin azomethine [2]-rotaxane formation by semi-empirical method PM3")
Authors
Aurica Farcas, Adrian Fifere, Iuliana Stoica, Flavian Farcas, Ana-Maria Resmerita,