The mechanism of tautomerisation and geometric isomerisation in thioformic acid and its water complexes: exploring chemical pathways for water migration-Reference-Cited by-同舟云学术

The mechanism of tautomerisation and geometric isomerisation in thioformic acid and its water complexes: exploring chemical pathways for water migration

Published:2014 Issue:44 Volume:16 Page:24401-24416
ISSN:1463-9076
Container-title:Phys. Chem. Chem. Phys.
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kaur Gurpreet¹²³⁴,Vikas Vikas¹²³⁴^ORCID

Affiliation:

1. Quantum Chemistry Group

2. Department of Chemistry & Centre of Advanced Studies in Chemistry

3. Panjab University

4. Chandigarh-160014, India

Abstract

Through a systematic and an automated search using a global reaction route mapping method, this work reports uncovered pathways for cis–trans and thione–thiol isomerisation in TFA and its water-complexes besides exploring the routes for water-migration.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2014/CP/C4CP03481C

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