- Ionic liquid,
- Chitin,
- Chitosan,
- Cellulose,
- Interactions
Copyright (c) 2018 Journal of the Chilean Chemical Society
This work is licensed under a Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International License.
Abstract
In order to deepen understanding the interactions between ionic liquid and chitin/chitosan/ cellulose at the molecular level, we have performed a study on the electronic structures, topological properties, nonconvalent interactions between 1-ethyl-3-methyl imidazolium chloride and chitin/chitosan/cellulose by using density functional theory. The results indicate that interactions between chitin/chitosan/cellulose and 1-ethyl-3-methyl imidazolium chloride are stronger that the intra-interaction of chitin/chitosan/cellulose, implying that chitin/ chitosan/ cellulose can dissolve in 1-ethyl-3-methyl imidazolium chloride.
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