Magnetic coupling in a hybrid Mn(ii) acetylene dicarboxylate

Hendon, Christopher H., Pradaux-Caggiano, Fabienne, Hatcher, Lauren E. ORCID: https://orcid.org/0000-0002-1549-9727, Gee, William J., Wilson, Chick C., Butler, Keith T., Carbery, David R., Walsh, Aron and Melot, Brent C. 2016. Magnetic coupling in a hybrid Mn(ii) acetylene dicarboxylate. Physical Chemistry Chemical Physics 18 (48) 10.1039/C6CP06886C

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Abstract

The design of ligands that mediate through-bond long range super-exchange in metal–organic hybrid materials would expand chemical space beyond the commonly observed short range, low temperature magnetic ordering. Here we examine acetylene dicarboxylate as a potential ligand that could install long range magnetic ordering due to its spatially continuous frontier orbitals. Using a known Mn(II)-containing coordination polymer we compute and measure the electronic structure and magnetic ordering. In this case, the latter is weak owing to the sub-optimal ligand coordination geometry, with a critical temperature of 2.5 K.

Item Type:	Article
Date Type:	Publication
Status:	Published
Schools:	Chemistry
Publisher:	Royal Society of Chemistry
ISSN:	1463-9076
Date of First Compliant Deposit:	19 March 2020
Date of Acceptance:	18 November 2016
Last Modified:	07 Nov 2023 00:50
URI:	https://orca.cardiff.ac.uk/id/eprint/130502

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