www.elsevier.nl/locate/poly Polyhedron 19 (2000) 2689 – 2695 Synthesis, spectral properties, crystal structures and antimicrobial effects of copper(II) pyridinecarboxylate adducts with chelating ligands Martina Palicova ´ a, *, Peter Segl’a a , Dus ˇan Miklos ˇ a , Miroslava Kopcova ´ a , Milan Melnı ´k a , Barbora Dudova ´ b , Daniela Hudecova ´ b , Tadeusz Glowiak c a Department of Inorganic Chemistry, Sloak Technical Uniersity, 812 37 Bratislaa, Sloak Republic b Department of Biochemistry and Microbiology, Sloak Technical Uniersity, 812 37 Bratislaa, Sloak Republic c Institute of Chemistry, Uniersity of Wroclaw, F. Joliot -Curie 14, 50 383 Wroclaw, Poland Received 27 July 2000; accepted 8 September 2000 Abstract The reaction of an ethanolic solution of copper(II) pyridinecarboxylates CuX 2 ·n H 2 O (where X is nicotinate (nic) (n =0) or isonicotinate (isonic) (n =4)) with ethylenediamine (en) in a molar ratio of 1:2 lead to the isolation of solid tetragonally distorted octahedral complexes of the type [Cu(en) 2 (H 2 O) 2 ]X 2 ·n H 2 O(n =1 for nic; n =0 for isonic). The analogous reaction of CuX 2 ·n H 2 O with diethylenetriamine (dien) in a molar ratio of 1:1 leads to the formation of square-pyramidal pentacoordinated complexes of the type [CuX(dien)(H 2 O)]X. On the other hand, the reaction of equimolar quantities of copper(II) nitrate and dien with nicotinate anions (equimolar quantities of pyridinecarboxylic acid and NaOH) in ethanolic solutions gives a solid monomeric complex [Cu(nic)(NO 3 )dien)(H 2 O)]·H 2 O in which the coordination polyhedron around the Cu(II) atom is a (4 +1 +1) distorted tetragonal bipyramid. Based on the molecular structure the electronic and IR spectra are discussed. Moreover, the results of the quantitative determination of antimicrobial activity of the isonic complexes [Cu(isonic) 2 (H 2 O) 4 ], [Cu(en) 2 (H 2 O) 2 ](isonic) 2 , [Cu(isonic)(dien)(H 2 O)](isonic), as well as isonicotinic acid, ethylenediamine and diethylenetriamine alone are discussed. © 2000 Elsevier Science B.V. All rights reserved. Keywords: Chelating ligands; Crystal structures; Copper(II) complexes; Pyridinecarboxylate complexes; Antimicrobial activity 1. Introduction Carboxylatocopper(II) complexes are interesting from both a chemical and biological point of view. Different possible coordinations of the carboxyl group to the central atom lead to the existence of compounds with distinct crystal structures. Pyridinecarboxylic acid and its derivatives possessing very interesting pharma- ceutical properties constitute an important group of anthelmintics and vitamins. It is known that some drugs act via chelation [1] or via inhibition of metal- loenzymes [2], but little is known about the modifica- tion of activity of most drugs when their ligating potential is utilized. Synthesis, spectral and thermal properties of various complexes CuX 2 ·n H 2 O (where X is pyridine-3-carboxy- late or nicotinate (nic) and pyridine-4-carboxylate or isonicotinate (isonic); n =0–4) have been reported [3,4]. Only a few structures of [CuX 2 (H 2 O) 4 ] [5] and their adducts with chelating ligands 1,10-phenanthroline and 2,2-bipyridine have been reported [6,7]. Different coor- dination modes of the pyridinecarboxylate (coordinated not only through the carboxylate group, but also through the nitrogen atom of the pyridine ring) lead to formation of mononuclear [5] or polynuclear [6,7] struc- tures. Recently, we have studied [8] the adducts of Cu(II) isonicotinate with ethylenediamine (en) and di- ethylenetriamine (dien), prepared [Cu(en) 2 (H 2 O) 2 ]- (isonic) 2 and [Cu(isonic)(dien)(H 2 O) 1.5 ]·0.5SO 4 ·2.5H 2 O and solved their structures by X-ray analysis. * Corresponding author. Tel.: +421-7-593-25611; fax: +421-7- 524-93198. E-mail address: palicova@chtf.stuba.sk (M. Palicova ´). 0277-5387/00/$ - see front matter © 2000 Elsevier Science B.V. All rights reserved. PII:S0277-5387(00)00585-4