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Molecular modeling, spectral, and biological studies of 4-formylpyridine-4 N-(2-pyridyl) thiosemicarbazone (HFPTS) and its Mn(II), Fe(III), Co(II), Ni(II), Cu(II), Cd(II), Hg(II), and UO2(II) complexes

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Abstract

The present work describes the preparation and characterization of some metal ion complexes derived from 4-formylpyridine-4 N-(2-pyridyl)thiosemicarbazone (HFPTS). The complexes have the formula; [Cd(HFPTS)2H2O]Cl2, [CoCl2(HPTS)]·H2O, [Cu2Cl4(HPTS)]·H2O, [Fe (HPTS)2Cl2]Cl·3H2O, [Hg(HPTS)Cl2]·4H2O, [Mn(HPTS)Cl2]·5H2O, [Ni(HPTS)Cl2]·2H2O, [UO2(FPTS)2(H2O)]·3H2O. The complexes were characterized by elemental analysis, spectral (IR, 1H-NMR and UV–Vis), thermal and magnetic moment measurements. The neutral bidentate coordination mode is major for the most investigated complexes. A mononegative bidentate for UO2(II), and neutral tridentate for Cu(II). The tetrahedral arrangement is proposed for most investigated complexes. The biological investigation displays the toxic activity of Hg(II) and UO2(II) complexes, whereas the ligand displays the lowest inhibition activity toward the most investigated microorganisms.

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References

  1. Whitnall M, Howard J, Ponka P, Richardson DR. A class of iron chelators with a wide spectrum of potent antitumor activity that overcomes resistance to chemotherapeutics. Proc Natl Acad Sci USA. 2006;103:14901–6.

    Article  CAS  Google Scholar 

  2. Uesugi K, Sik LJ, Nishioka H, Kumagai T, Nagahiro T. Extraction-spectrophotometric determination of palladium with 3-thiophenaldehyde-4-phenyl-3-thiosemicarbazone. Microchem J. 1994;50:88–93.

    Article  CAS  Google Scholar 

  3. Kurup MRP, Joseph M. Transition metal complexes of furan-2-aldehyde thiosemicarbazone. Synth React Inorg Met Org Chem. 2003;33:1275–87.

    Article  Google Scholar 

  4. Klayman DL, Bartosevich JF, Griffin TS, Mason CJ, Scovill JP. 2-Acetylpyridine thiosemicarbazones. 1. A new class of potential antimalarial agents. J Med Chem. 1979;22:862–85.

    Article  Google Scholar 

  5. Padhyé S, Kauffman GB. Transition metal complexes of semicarbazones and thiosemicarbazones. Coord Chem Rev. 1985;63:127–60.

    Article  Google Scholar 

  6. Abou-Melha KS. Octahedral Co(II) and Ni(II) complexes of Schiff bases, semicarbazone and thiosemicarbazone, synthesis, biological, spectral, and thermal studies. J Coord Chem. 2008;61:2053–67.

    Article  CAS  Google Scholar 

  7. Voronkova VK, Mosina LV, Yablokov YuV, Yampol’skaya MA, Matuzenko GS, Simonov YA, Kuyavskaya BY, Gerbeleu NV, Bel’skii VK. Structures, magnetic parameters, and ESR spectra of dimeric copper(II) methoxonitrophenolates containing coordinated pyridine. J Struct Chem. 1887;27:562–71.

    Article  Google Scholar 

  8. Leovac VM, Divjaković V, Češljević VI, Engel P. Transition metal complexes with the thiosemicarbazide-based ligands-I. Nickel(II) complexes with the quadridentate ligands based on S-methylisothiosemicarbazide; X-ray crystal structure of (acetyl-acetone N(1)-salicylidene-S-methylizothiosemicarbazonato) nickel(II). Polyhedron. 1987;6:1901–7.

    Article  CAS  Google Scholar 

  9. Forni A, Gradinaru J, Druta V, Zecchin S, Quici S, Gerbeleu N. Cu(II) complexes with asymmetrical [N3O] Schiff-base ligands derived from S-methylisothiosemicarbazide. Inorg Chim Acta. 2003;353:336–43.

    Article  CAS  Google Scholar 

  10. Kuyavskaya BY, Ivlava IN, Yampol’skaya MA, Gérbéléu NV, Veksel’man MK. Magnetic properties of tetrameric μ3-methoxophenolates of nickel(II). Theor Exp Chem. 1998;22:266–72.

    Article  Google Scholar 

  11. Leovac VM, Petrovic AF, Ivegeš EZ, Lukic SR. Transition metal complexes with thiosemicarbazide-based ligands-XI. Dioxovanadium(V) complexes with aromatic aldehyde thio and S-methylisothiosemicarbazones. J Therm Anal. 1990;36:2427–39.

    Article  CAS  Google Scholar 

  12. Leovac VM, Ivegeš EZ, Galešić N, Horvatić D, Transition metal complexes with the thiosemicarbazide-based ligands Part X. The complexes of UO2(II) with S-methyl-1,4-bis(salicylidene)-isothiosemicarbazide (H2L): [UO2(L)A] (A = MeOH, EtOH, DMF). Crystal structure of [UO2(L)DMF], Inorganic Chimica Acta. 1989;162:277–280.

    Google Scholar 

  13. HyperChem Professional 8, Hypercube, Inc., Gainesville, FL 32601, USA. (http://www.hyper.com) 2007.

  14. Vogel AI. A text book of quantitative inorganic analysis. London: Longman; 1994.

    Google Scholar 

  15. El-Ayaan U, Youssef MM, Al-Shihry S, Mn(II), Co(II), Zn(II), Fe(III) and U (VI) complexes of 2-acetylpyridine 4N-(2-pyridyl) thiosemicarbazone (HAPT); structural, spectroscopic and biological studies, J. Mol Struct. 2009;936:213–219.

    Google Scholar 

  16. Bauer AW, Kirby WM, Sherris JC, Turck M, Antibiotic susceptibility testing by a standardized single disk method, Am J Clin Pathol. 1966;45:493–496.

    Google Scholar 

  17. Allinger NL. Conformational analysis. 130. MM2. A hydrocarbon force field utilizing V1 and V2 torsional terms. J Am Chem Soc. 1977;99(25):8127–34.

    Article  CAS  Google Scholar 

  18. Zaki ZM, Mohamed GG. Spectral and thermal studies of thiobarbituric acid complexes. Spectrochim Acta A. 2000;56(7):1245–50.

    Article  Google Scholar 

  19. Refat MS, El-Metwaly NM, Spectral, thermal and biological studies of Mn(II) and Cu(II) complexes with two thiosemicarbazide derivatives, Spectrochimica Acta Part A. 2012;92:336–346.

    Google Scholar 

  20. McGlynn SP, Smith JK. The electronic structure, spectra, and magnetic properties of actinyl ions. Part II. Neptunyl, and the ground states of other actinyls. J Mol Spectrosc. 1961;6(188):198.

    Google Scholar 

  21. Lever ABP. Inorganic Electronic Spectroscopy. 1st ed. Amsterdam: Elsevier; 1968.

    Google Scholar 

  22. Cotton FA, Wilkinson G, Murillo CA, Bochmann M. Advanced Inorganic Chemistry. 6th ed. New York: Wiley; 1999.

    Google Scholar 

  23. Zhu D-R, Song Y, Xu Y, Zhang Y, Sundara Raj SS, Fun H-K, You X-Z. Syntheses, crystal structures and properties of the novel Co(II) and Ni(II) complexes with 4-(p-methylphenyl)-3,5-bis(pyridin-2-yl)-1,2,4-triazole. Polyhedron. 2000;19:2019–25.

    Article  CAS  Google Scholar 

  24. Abou-Hussen AA, El-Metwally NM, Saad EM, El-Asmy AA. Spectral, magnetic, thermal and electrochemical studies on phthaloyl bis(thiosemicarbazide) complexes. Coord Chemistry. 2005;58(18):1735–49.

    Article  CAS  Google Scholar 

  25. Speier G, Csihony J, Whalen AM, Pierpont CG. Iminoquinone coordination to copper(I) in the [Cu(PhenoxBQ) (μ-Cl)]2 dimer. Inorg Chem. 1996;245:1–5.

    CAS  Google Scholar 

  26. Kumbhar AS, Padhye SB, West DX, Liberta AE. Electrochemical studies of copper(II) 2-acetylpyridine 4N-dialkylthiosemicarbazones. Relation to their spectral, magnetic, and biological properties. Transition Met Chem. 1991;16:276–9.

    Article  CAS  Google Scholar 

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Acknowledgments

The financial support by the Deanship of Scientific Research (Project No. 130164) King Faisal University, Saudi Arabia is gratefully acknowledged.

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Correspondence to Nashwa M. El Metwally.

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El Metwally, N.M., Arafa, R. & El-Ayaan, U. Molecular modeling, spectral, and biological studies of 4-formylpyridine-4 N-(2-pyridyl) thiosemicarbazone (HFPTS) and its Mn(II), Fe(III), Co(II), Ni(II), Cu(II), Cd(II), Hg(II), and UO2(II) complexes. J Therm Anal Calorim 115, 2357–2367 (2014). https://doi.org/10.1007/s10973-013-3065-8

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