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Self-assembly hydrogen-bonded supramolecular arrays from copper(II) halogenobenzoates with nicotinamide: Structure and EPR spectra

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Abstract

Nicotinamide was employed as a supramolecular reagent in the synthesis of six new copper(II) bromo-, iodo-, fluoro- and dibromobenzoate complexes. Structures of [Cu(2-Brbz)2(nia)2(H2O)2] (I), [Cu(2-Ibz)2(nia)2(H2O)2] (II), [Cu(2-Fbz)2(nia)2(H2O)2] (III), [Cu(4-Brbz)2(nia)2(H2O)2] (IV), [Cu(3,5-Br2bz)2(nia)2(H2O)2] (V), [Cu(F-Fbz)2(nia)2(H2O)] · H2O (VI) (nia = nicotinamide, 2-Brbz = 2-bromobenzoate, 4-Brbz = 4-bromobenzoate, 3,5-Br2bz = 3,5-dibromobenzoate, 2-Ibz = 2-iodobenzoate, 2-Fbz = 2-fluorobenzoate, 4-Fbz = 4-fluorobenzoate) were determined using X-ray analysis. Compound [Cu(2-Brbz)2(nia)2] · 2H2O (VII) was prepared by a new method and also characterized by X-ray powder diffraction and EPR spectroscopy. Compounds I–V are monomeric complexes with a square-bipyramidal coordination sphere around the Cu2+ ion. Complex VI is monomeric with coordination environment around the Cu2+ ion of a tetragonal-pyramid. Complexes I and VII present examples of coordination isomerism. Molecules of all compounds are connected by N—H⋯O and O—H⋯O hydrogen bonds from the NH2 groups of nicotinamide and water molecules which create supramolecular hydrogen-bonding-coordination chains and networks.

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Authors and Affiliations

  1. Faculty of Chemical and Food Technology, Slovak University of Technology, SK-81237, Bratislava, Slovakia

    Jozef Halaška, Danica Čechová, Michael K. Lawson, Vladimír Jorík, Marian Koman, Marian Valko & Ján Moncol

  2. Department of General and Inorganic Chemistry, Faculty of Chemical Technology, University of Pardubice, CZ-53210, Pardubice, Czech Republic

    Zdeňka Růžičková

  3. Faculty of Chemistry and Chemical Technology, University of Ljubljana, 1000, Ljubljana, Slovenia

    Bojan Kozlevčar

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  1. Jozef Halaška
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Halaška, J., Čechová, D., Lawson, M.K. et al. Self-assembly hydrogen-bonded supramolecular arrays from copper(II) halogenobenzoates with nicotinamide: Structure and EPR spectra. Chem. Pap. 70, 101–113 (2016). https://doi.org/10.1515/chempap-2015-0203

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