Experimental and computational investigations of a cadmium(II) mononuclear complex with 2,6-Bis(3,5-dimethyl-N-pyrazolyl)pyridine (bdmpp) and selenocyanate as ligands

Central European Journal of Chemistry

Volumn 7, Issue 3, 2009, Pages 402-409

  Odabaşioǧlu, Sinem ^a   Kurtaran, Raif ^a   Azizoglu, Akin ^a   Kara, Hülya ^a   Öz, Sevi ^b   Atakol, Orhan ^b  

^a BALIKESIR UNIVERSITY   (Turkey)

^b ANKARA UNIVERSITY   (Turkey)

Author keywords

DFT, ab initio; NMR analysis, chirality; Octahedral geometry Cd(II) complexes; Pyrazolyl complexes; Selenocyanate; Thermal analysis

Indexed keywords

EID: 67649845501     PISSN: 18951066     EISSN: 16443624     Source Type: Journal    
DOI: 10.2478/s11532-009-0027-x     Document Type: Article

References (32)

1. L. Jameson, K.A. Goldsby, J. Org. Chem. 55, 4992 (1990)
2. R. Kurtaran, H. Namli, C. Kazak, O. Turhan, O. Atakol, J. Coord. Chem. 60, 2133 (2007)
3. C. Arici, D. Ülkü, R. Kurtaran, K.C. Emregül, O. Atakol, Z. Kristallogr. 218, 497 (2003)
4. R. Kurtaran, S. Odabasioglu, A. Azizoglu, H. Kara, O. Atakol, Polyhedron 26, 5069 (2007)
5. R. Kurtaran, C. Arici, K.C. Emregül, D. Ülkü, O. Atakol, M. Tastekin, Z. Anorg. Allg. Chem. 629, 1617 (2003)
6. F. Ercan, C. Arici, D. Ülkü, R. Kurtaran, M. Aksu, O. Atakol, Z. Kristallogr. 219, 295 (2004)
7. C. Diaz, J. Ribas, N. Sanz, X. Solans, M.C. Bardia, Inorg. Chim. Acta 286, 169 (1999)
8. A. Escuer, R. Vicente, F.A. Mautner, M.A.S. Goher, Inorg. Chem. 36, 1233 (1997); b) H-P. Jia, W. Li, Z-F Ju, J. Zhang, Inorg. Chem. Commun. 10, 397 (2007)
9. L. Pazderski, A. Surdykowski, M. Pazderska-Szablowicz et al., Cent. Eur. J. Chem. 6, 55 (2008); b) H.R. Khavasi, A. Abedi, V. Amani et al., Polyhedron 27, 1848 (2008); c) M.D. Brown, J.M. Dyke, F.Ferrante, W. Levason, J.S. Ogden, M. Webster, Chem. Eur. J. 12, 2620 (2006)
10. H. Grove, M. Julve, F. Lloret, P.E. Kruger, K.W. Törnroos, J. Sletten, Inorg. Chim. Acta 325, 115 (2001) b) A.V. Chekhlov, J. Struct. Chem. 44, 335 (2003)
11. C.R. Choudhury, S.K. Dey, N. Mondal, S. Mitra, V. Gramlich, Inorg. Chim. Acta 353, 217 (2003)
12. T.K. Maji, G. Mostafa, P.S. Mukherjee, A. Mondal, A.J. Welch, K. Okamoto, N.R. Chaudhuri, Polyhedron 19, 1903 (2000)
13. B.S. Furniss, A.J. Hannaford, P.W.G. Smith, A.R. Tatchell, Vogel's Textbook of Practical Organic Chemistry, 5th Edition (Longman, Scientific and Technical, London, 1989) 1149
14. SAINT integration software version 7.06A (Bruker AXS, Madison, WI, 1997-2003)
15. SHELXTL program system version 6.14 (Bruker AXS Inc., Madison, WI, 2000-2003)
16. SMART diffractometer control software version 5.628(APEX) (Bruker AXS Inc., Madison, WI, 1997-2002)
17. G.M. Sheldrick, SADABS version 2.05 (University of Göttingen, Germany, 2003)
18. H.D. Flack, Acta Cryst. A39, 876 (1983)
19. CCDC-651075 contains the supplementary crystallographic data for this paper. These data can be obtained free of charge via www.ccdc.cam.ac.uk/ data_request/cif, or by emailing data_request@ccdc.cam.ac.uk, or by contacting The Cambridge Crystallographic Data Centre, 12, Union Road, Cambridge CB2 1EZ, UK; fax: +44 1223 336033
20. M.J. Frisch et al., Gaussian 03, Revision C02 (Gaussian Inc., Pittsburgh PA, 2003)
21. R. Dennington II, T. Keith, J. Millam, K. Eppinnett, W.L. Hovell, R. Gilliland, GaussView, Version 3.09 (Semichem, Inc., Shawnee Mission, KS, 2003)
22. W.J. Hehre, L. Radom, P.V. Schleyer, J. Pople, Ab initio molecular orbital theory (Wiley, New York, 1986)
23. F. Jensen, Introduction to computational chemistry (Wiley, UK, 1999)
24. P.J. Hay, W.R. Wadt, J. Chem. Phys. 82, 299 (1985)
25. J.D. Dunitz, Chem. Commun. 545 (2003)
26. E. Pidcock, W.D.S. Motherwell, Cryst. Growth & Des. 4, 611 (2004)
27. D.W.M. Hofmann, L.N. Kuleshova, M.Y. Antipin, Cryst. Growth & Des. 4, 1395 (2004)
28. S-L. Li, J-Y. Wu, Y-P. Tian, H. Ming, P. Wang, M-H. Jiang, K-K. Fun, Eur. J. Inorg. Chem. 2900 (2006)
29. S.A. Willison, H. Jude, R.M. Antonelli, J.M. Rennekamp, N.A. Eckert, A. Jeanette, B. Krause, W.B. Connick, Inorg. Chem. 43, 2548 (2004)
30. R.G. Bray, J. Ferguson, C.J. Hawkins, Aust. J. Chem. 22, 2091 (1969); (b) T. Ohno, S. Kato, Bull. Chem. Soc. Jpn. 47, 2953 (1974)
31. I. Fleming, Frontier Orbitals and Organic Chemical Reactions (Wiley, London, 1976); b) L. Turker, A. Azizoglu, J. Mol. Struct. (THEOCHEM) 535, 151 (2001); c) A. Azizoglu, Struct. Chem. 14, 575 (2003); d) A. Virdi, V.P. Gupta, A. Sharma, Cent. Eur. J. Chem. 2, 456 (2004); e) B.B. Koleva, T. Kolev, R. Nikolova, Y. Zagraniarsky, M. Spiteller, Cent. Eur. J. Chem. 6, 592 (2008)
32. Q.M. Wang, G.C. Guo, T.C.W. Mak, Polyhedron 20, 2683 (2001); b) M. Broering, S. Prikhodovski, E.C. Tejero, S. Koehler, Eur. J. Inorg. Chem. 1010 (2007)