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Insight into polymorphism in weakly polar systems using favorable connection motifs.

Authors :
Liu, Yumin
Gong, Junbo
Yan, Dongpeng
Wang, Jingkang
Source :
CrystEngComm. 1/14/2024, Vol. 26 Issue 2, p153-159. 7p.
Publication Year :
2024

Abstract

We explore the polymorphism of a weakly polar molecule, dibenzoylmethane, in which the intramolecular hydrogen-bonded enol "chelated" form is favoured. A simple geometric method on the basis of interatomic distance to visualize and count favourable connections between non-hydrogen atoms was constructed to judge the strength of intermolecular interactions in polymorphs of this kind of weakly polar molecule. The number of total favourable connections mirrored with resonance-assisted hydrogen bonds (RAHB) and aromatic interactions in DBM polymorphs increases from forms I to III, in agreement with the order of their equivalent interaction energies, proving that it is feasible for this geometric approach to be used in this weakly polar system. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
14668033
Volume :
26
Issue :
2
Database :
Academic Search Index
Journal :
CrystEngComm
Publication Type :
Academic Journal
Accession number :
174564872
Full Text :
https://doi.org/10.1039/d3ce00856h