JOURNAL OF CHILEAN CHEMICAL SOCIETY

Vol 62 No 4 (2017): Journal of the Chilean Chemical Society
Original Research Papers

THEORETICAL STUDY ON INTERACTIONS BETWEEN IONIC LIQUID AND CHITIN/CHITOSAN/ CELLULOSE

Renqing Lü
College of Science, China University of Petroleum (East China)
Jin Lin
College of Chemical Engineering, China University of Petroleum (East China)
Xin Zhao
College of Chemical Engineering, China University of Petroleum (East China)
Published February 9, 2018
Keywords
  • Ionic liquid,
  • Chitin,
  • Chitosan,
  • Cellulose,
  • Interactions

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.

References

  1. M. Rinaudo, Prog. Polym. Sci., 2006, 31, 603-632.
  2. R. P. Swatloski, S. K. Spear, J. D. Holbrey, R. D. Rogers, J. Am. Chem. Soc., 2002, 124, 4974-4975.
  3. H. Wang, G. Gurau, R. D. Rogers, Chem. Soc. Rev., 2012, 41, 1519-1537.
  4. H. Xie, S. Zhang, S. Li, Green Chem., 2006, 8, 630–633.
  5. R. C. Remsing, R. P. Swatloski, R. D. Rogers, G. Moyna, Chem. Commun., 2006, 1271-1273.
  6. D. A. Fort, R. C. Remsing, R. P. Swatloski, P. Moyna, G. Moyna, R. D. Rogers, Green Chem., 2007, 9, 63–69.
  7. N. Sun, M. Rahman,Y. Qin, M. L. Maxim, H. Rodrıguez, R. D. Rogers, Green Chem., 2009, 11, 646–655.
  8. B. Kosan, C. Michels, F. Meister, Cellulose, 2008, 15, 59–66.
  9. S. Zhu, Y. Wu, Q. Chen, Z. Yu, C. Wang, S. Jin, Y. Ding, G. Wu, Green Chem., 2006, 8, 325–327.
  10. J. Vitz, T. Erdmenger, C. Haensch, U. S. Schubert, Green Chem., 2009, 11, 417–424.
  11. S. Barthela, T. Heinze, Green Chem., 2006, 8, 301-306.
  12. A. Pinkert, K. N. Marsh, S. Pang, M. P. Staiger, Chem. Rev., 2009, 109, 6712–6728.
  13. L. Feng, Z. Chen, J. Mol. Liq., 2008, 142, 1-5.
  14. R. S. Payal, R. Bharath, G. Periyasamy, S. Balasubramanian, J. Phys. Chem. B, 2012, 116, 833–840.
  15. Z. Ding, Z. Chi, W. Gu, S. Gu, J. Liu, H. Wang, Carbohyd. Polym., 2012, 89, 7-16.
  16. Y. Zhao, X. Liu, J. Wang, S. Zhang, Carbohyd. Polym., 2013, 94, 723-730.
  17. Q. Tian, S. Liu, X. Sun, H. Sun, Z. Xue, T. Mu, Carbohyd. Res., 2015, 408, 107-113.
  18. Y. Yao, Y. Li, X. Liu, X. Zhang, J. Wang, X. Yao, S. Zhang, Chin. J. Chem. Eng., 2015, 23(11), 1894-1906.
  19. B. Cao, J. Du, D. Du, H. Sun, X. Zhu, H. Fu, Carbohyd. Polym., 2016, 149, 348-356.
  20. B. Delley, J. Chem. Phys., 1990, 92, 508-517.
  21. B. Delley, J. Chem. Phys., 2000, 113, 7756-7764.
  22. S. F. Boys, F. Bernardi, Mol. Phys., 1970, 19, 553-566.
  23. F. Biegler-Konig, J. Schonbohm, J. Comput. Chem., 2002, 23, 1489-1494.
  24. T. Lu, F. Chen, J. Mol. Graph. Model., 2012, 38, 314-323.
  25. T. Lu, F. Chen, J. Comput. Chem., 2012, 33, 580-592.
  26. A. Bondi, J. Phys. Chem., 1964, 68, 441-451.
  27. P. Lipkowski, S. J. Grabowski, T. L. Robinson, J. Leszczynski, J. Phys. Chem. A, 2004, 108, 10865-10872.
  28. E. R. Johnson, S. Keinan, P. Mori-Sánchez, J. Contreras-García, A. J. Cohen, W. Yang, J. Am. Chem. Soc., 2010, 132, 6498-6506.

Copyright @2019 | Designed by: Open Journal Systems Chile Logo Open Journal Systems Chile Support OJS, training, DOI, Indexing, Hosting OJS

Code under GNU license: OJS PKP