title: Towards a better understanding of magnetic exchange mediated by hydrogen bonds in Mn(III)/Fe(III) salen-type supramolecular dimers.
abstract: A thorough study of structural and magnetic properties was performed on a series of trinuclear and dinuclear Mn(III)/Fe(III) complexes consisting of [M(L4)(Solv)](+) and [Fe(CN)5(NO)](2-) moieties (M = Fe(III) or Mn(III), Solv = H2O or CH3OH, L4 = tetradentate salen-type ligands), in which dominant magnetic exchange is mediated by O(S)-H···O(Ph) hydrogen bonds in [M(L4)(Solv)](+)···[M(L4)(Solv)](+) supramolecular dimers. As deduced from magnetic analysis involving the determination of zero-field splitting (ZFS) parameters for Mn(III) and Fe(III) ions, as well as from comprehensive DFT calculations and modelling, it may be concluded that the strength of the magnetic exchange is correlated with the number of hydrogen bonds and with the O(Ph)···O(S) distance between the phenolic oxygen atom of the salen-type ligand (O(Ph)) and the oxygen atom of the solvent molecule coordinated to the adjacent metal atom (O(S)).
authors.affiliation: Regional Centre of Advanced Technologies and Materials & Department of Inorganic Chemistry, Faculty of Science, Palacký University, 17. listopadu 12, 771 46, Olomouc, Czech Republic. zdenek.travnicek@upol.cz.
authors.forename: Ivan
authors.initials: I
authors.lastname: Nemec
authors.forename: Radovan
authors.initials: R
authors.lastname: Herchel
authors.forename: Tomáš
authors.initials: T
authors.lastname: Šilha
authors.forename: Zdeněk
authors.initials: Z
authors.lastname: Trávníček