Elucidating mechanochemical reactivity of a ternary halogen-bonded cocrystal system by computational and calorimetric studies-Reference-Cited by-同舟云学术

Elucidating mechanochemical reactivity of a ternary halogen-bonded cocrystal system by computational and calorimetric studies

Published:2023 Issue:42 Volume:25 Page:28576-28580
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kumar Lavanya¹^ORCID,Dash Sibananda G.¹^ORCID,Leko Katarina²^ORCID,Trzybiński Damian³^ORCID,Bregović Nikola²^ORCID,Cinčić Dominik²^ORCID,Arhangelskis Mihails¹^ORCID

Affiliation:

1. Faculty of Chemistry, University of Warsaw, 1 Pasteura Street, Warsaw 02-093, Poland

2. Faculty of Science, Department of Chemistry, University of Zagreb, Horvatovac 102a, Zagreb HR-10000, Croatia

3. Biological and Chemical Research Centre, University of Warsaw, 101 Żwirki i Wigury Street, Warsaw 02-089, Poland

Abstract

Mechanochemical interconversions of a three-component halogen-bonded cocrystal system revealed a complex landscape of multicomponent phases, where all transformations were explained by periodic DFT calculations and dissolution calorimetry measurements.

Funder

European Regional Development Fund

Infrastruktura PL-Grid

Hrvatska Zaklada za Znanost

Narodowe Centrum Nauki

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP04358D

Reference56 articles.

1. Halogen bonding for molecular recognition: new developments in materials and biological sciences

2. Introduction: Molecular Recognition

3. The hydrogen bond and crystal engineering

4. Crystal Engineering: A Holistic View

5. The Hydrogen Bond in the Solid State

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