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

  • Halaška Jozef , Čechová Danica , Michael K. Lawson , Zdeňka Růžičková , Vladimír Jorík , Marian Koman , Marian Valko , Bojan Kozlevčar and Ján Moncol EMAIL logo
Published/Copyright: January 22, 2016
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Chemical Papers
From the journal Chemical Papers Volume 70 Issue 1

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-Br2 bz)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-Br2 bz = 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.·c 2015 Institute of Chemistry, Slovak Academy of Sciences

Keywords: copper(II) complexes; nicotinamide; crystal structure; EPR; supramolecular network

‡Presented at the XXV. International Conference on Coordination and Bioinorganic Chemistry, Smolenice, Slovakia, 31 May–5 June 2015.

Acknowledgements.

Slovak grant agencies VEGA (VEGA 1/0388/14, VEGA 1/0765/14) and APVV (APVV-14-0078)are acknowledged for financial support.

Supplementary data

Supplementary data associated with this article can be found in the online version of this paper (DOI: 10.1515/chempap-2015-0203). Crystallographic data (excluding structure factors) for structures I–VI reported in this paper have been deposited with the Cambridge Crystallographic Data Centre, CCDC nos. 910178, 910179, 1013567, 910180, 910181and 1026303. Copies of the information may be obtained free of charge from: The Director, CCDC, 12 Union Road, Cambridge CB2 1EZ, UK (fax: +44 1223-336033; e-mail: ) or via http://www.ccdc.cam.ac.uk/data request/cif.

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Received: 2015-6-10
Revised: 2015-8-19
Accepted: 2015-8-23
Published Online: 2016-1-22
Published in Print: 2016-1-1

© 2015 Institute of Chemistry, Slovak Academy of Sciences

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https://doi.org/10.1515/chempap-2015-0203
Keywords for this article
copper(II) complexes; nicotinamide; crystal structure; EPR; supramolecular network

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  2. Mononuclear and heterodinuclear phenanthrolinedione complexes of d- and f-block elements‡
  3. Original Paper
  4. New heteroscorpionate lanthanide complexes for ring-opening polymerisation of ɛ-caprolactone and rac-lactide‡
  5. Original Paper
  6. EPR on bis(1,2-dithiosquarato)cuprate(II) in the bis(1,2-dithiosquarato)nickelate(II) host lattice – structure and spectroscopy‡
  7. Review
  8. Electric fields in zeolites: fundamental features and environmental implications‡
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