Kaur, Ramanpreet ; Perumal, S. S. R. R. ; Bhattacharyya, Aninda J. ; Yashonath, S. ; Guru Row, T. N. (2014) Structural insights into proton conduction in gallic acid–isoniazid cocrystals Crystal Growth & Design, 14 (2). pp. 423-426. ISSN 1528-7483
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Official URL: http://pubs.acs.org/doi/abs/10.1021/cg4018807
Related URL: http://dx.doi.org/10.1021/cg4018807
Abstract
Hydrated cocrystal of gallic acid–isoniazid displays a single crystal-to-single crystal transformation upon dehydration, resulting in a difference of three orders of magnitude in proton conduction. The conduction pathway is shown to follow the Grotthus mechanism, supported by theoretical (DFT) calculations.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to American Chemical Society. |
| ID Code: | 109136 |
| Deposited On: | 22 Dec 2017 10:15 |
| Last Modified: | 22 Dec 2017 10:15 |
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