| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5379142 | Chemical Physics Letters | 2016 | 16 Pages |
Abstract
- First time theoretical analysis of the inclusion process of prilocaine into the p-sulfonic-acid-calix[6]arenes.
- A sequential methodology based on DFT/PM3 calculations was performed.
- The hydrogen bonds and dispersion effect are relevant for complex stabilization.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
![Theoretical investigation on the molecular inclusion process of prilocaine into p-sulfonic acid calix[6]arene](/preview/png/5379142.png "First Page Preview: Theoretical investigation on the molecular inclusion process of prilocaine into p-sulfonic acid calix[6]arene")
Authors
Sara M.R. de Sousa, Sergio A. Fernandes, Wagner B. De Almeida, Luciana Guimarães, Paula A.S. Abranches, Eduardo V.V. Varejão, Clebio S. Nascimento Jr.,