Literature DB >> 16480289

Intra- and intermolecular proton transfer in 1H(2H)-1,2,3-triazole based systems.

Zhen Zhou, Rui Liu, Jenghan Wang, Siwen Li, Meilin Liu, Jean-Luc Brédas.   

Abstract

Hartree-Fock ab initio and density functional theory calculations suggest that intra- and intermolecular proton transfer between neutral and protonated triazole tautomers play a vital role in the observed dramatic proton conduction in triazole-based polymer electrolyte membranes.

Entities:  

Year:  2006        PMID： 16480289     DOI： 10.1021/jp057265q

Source DB:  PubMed          Journal:  J Phys Chem A        ISSN： 1089-5639            Impact factor:   2.781


  3 in total

1.  Precise equilibrium structures of 1H- and 2H-1,2,3-triazoles (C2H3N3) by millimeter-wave spectroscopy.

Authors:  Maria A Zdanovskaia; Brian J Esselman; Samuel M Kougias; Brent K Amberger; John F Stanton; R Claude Woods; Robert J McMahon
Journal:  J Chem Phys       Date:  2022-08-28       Impact factor: 4.304

2.  REGIOSELECTIVE SYNTHESIS OF EITHER 1H- OR 2H-1,2,3- TRIAZOLES VIA MICHAEL ADDITION TO α,ß-UNSATURATED KETONES.

Authors:  Sen Wai Kwok; Jason E Hein; Valery V Fokin; K Barry Sharpless
Journal:  Heterocycles       Date:  2008-11-01       Impact factor: 0.831

3.  HNO/NO Conversion Mechanisms of Cu-Based HNO Probes with Implications for Cu,Zn-SOD.

Authors:  Matthew A Michael; Gianna Pizzella; Liu Yang; Yelu Shi; Tiffany Evangelou; Daniel T Burke; Yong Zhang
Journal:  J Phys Chem Lett       Date:  2014-03-07       Impact factor: 6.475
  3 in total

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