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Analysis of an unusual hetero-halogen bonded trimer using charge density analysis: A case of concerted type I Br center dot center dot center dot Br and type II Br center dot center dot center dot Cl interactions

Pavan, Mysore S and Row, Tayur Guru N (2016) Analysis of an unusual hetero-halogen bonded trimer using charge density analysis: A case of concerted type I Br center dot center dot center dot Br and type II Br center dot center dot center dot Cl interactions. In: JOURNAL OF CHEMICAL SCIENCES, 128 (10). pp. 1579-1587.

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Official URL: http://dx.doi.org/10.1007/s12039-016-1149-2

Abstract

The crystal structure of 4-bromo-2-chlorobenzoic acid generates an unusual triangular motif consisting of a hitherto uncharacterized Type I Brai-Br contact along with two Type II Brai-Cl interactions as edges of the triangle. The nature of such bonding is analyzed based on both experimental and theoretical charge density followed by topological analysis.

Item Type: Journal Article
Additional Information: Copy right for this article belongs to the INDIAN ACAD SCIENCES, C V RAMAN AVENUE, SADASHIVANAGAR, P B #8005, BANGALORE 560 080, INDIA
Department/Centre: Division of Chemical Sciences > Solid State & Structural Chemistry Unit
Depositing User: Id for Latest eprints
Date Deposited: 07 Dec 2016 05:08
Last Modified: 07 Dec 2016 05:08
URI: http://eprints.iisc.ac.in/id/eprint/55481

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