Structure of zinc complexes with 3-(pyridin-2-yl)-5-(arylideneiminophenyl)- 1H-1,2,4-triazoles in different tautomeric forms: DFT and QTAIM study

Russian Journal of Inorganic Chemistry

Volumn 58, Issue 8, 2013, Pages 928-934

  Baryshnikov, G V ^a   Minaev, B F ^a   Korop, A A ^a   Minaeva, V A ^a   Gusev, A N ^b  

^a CHERKASY NATIONAL UNIVERSITY   (Ukraine)

^b TAURIDA NATIONAL V I VERNADSKY UNIVERSITY   (Ukraine)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; CHEMICAL ANALYSIS; CHEMICAL BONDS; COORDINATION REACTIONS; DIMETHYL SULFOXIDE; DISTRIBUTION FUNCTIONS; ELECTRON DENSITY MEASUREMENT; MOLECULAR CRYSTALS; QUANTUM CHEMISTRY; X RAY CRYSTALLOGRAPHY;

COORDINATION BONDS; CRYSTALLOGRAPHIC DATA; FLUORESCENCE QUANTUM YIELD; NONCOVALENT BOND; QUANTUM CHEMICAL ANALYSIS; SOLVATED COMPLEXES; TOPOLOGICAL PARAMETERS; VARIABLE COORDINATION;

ZINC COMPOUNDS;

EID: 84882251817     PISSN: 00360236     EISSN: None     Source Type: Journal    
DOI: 10.1134/S0036023613080032     Document Type: Article

References (23)

1. A. N. Gusev, V. F. Shul'gin, O. V. Konnic, et al., Inorg. Chim. Acta 376, 376 (2011).
2. A. N. Gusev, V. F. Shul'gin, M. A. Kiskin, et al., Russ. J. Coord. Chem. 37, 117 (2011).
3. A. N. Gusev, V. F. Shul'gin, M. A. Kiskin, et al., Russ. J. Coord. Chem. 37, 589 (2011).
4. A. N. Gusev, V. F. Shul'gin, S. B. Meshkova, et al., Russ. J. Inorg. Chem 56, 32 (2011).
5. N. S. Eremina, K. M. Degtyarenko, R. M. Gadirov, et al., Russ. Phys. J. 53, 533 (2010).
6. A. N. Gusev, Z. M. Topilova, and S. B. Meshkova, Ukr. Chem. J. 77(9), 7 (2011).
7. K. Patel, A. Kumar, and S. Durani, Biochim. Biophys. Acta. Proteins Proteomics 1774, 1247 (2007).
8. I. A. Zamilatskov, Extended Abstract of Candidate's Dissertation in Chemistry (MITKhT, Moscow, 2007).
9. A. D. Becke, J. Chem. Phys. 98, 5648 (1993).
10. C. Lee, W. Yang, and R. G. Parr, Phys. Rev. B 37, 785 (1988).
11. N. Godbout, D. R. Salahub, J. Andzelm, et al., Can. J. Chem. 70, 560 (1992).
12. C. Sosa, J. Andzelm, B. C. Elkin, et al., J. Phys. Chem. 96, 6630 (1992).
13. R. F. W. Bader, Atoms in Molecules: A Quantum Theory (Clarendon Press, Oxford, 1990).
14. V. A. Minaeva, B. F. Minaev, G. V. Baryshnikov, et al., Russ. J. Gen. Chem. 81, 2332 (2011).
15. T. A. Keith, AIMAll, version 10.07.25, TK Gristmill Software, Overland Park KS, USA, www.aim.tkgristmill.com, 2010.
16. E. Espinosa, E. Molins, and C. Lecomte, Chem. Phys. Lett. 285, 170 (1998).
17. E. Espinosa, I. Alkorta, and I. Rozas, Chem. Phys. Lett. 336, 457 (2001).
18. M. J. Frisch, G. W. Trucks, H. B. Schlegel, et al., GAUSSIAN03, Revision C.02, Gaussian, Inc., Wallingford, CN, 2004.
19. U. Koch and P. L. A. Popelier, J. Phys. Chem. 99, 9747 (1995).
20. B. Minaev, X. Li, Z. Ning, et al., Organic Light Emitting Diode-Material, Process and Devices (InTech, Croatia, 2001), p. 61.
21. A. N. Gusev, V. F. Shul'gin, Z. M. Topilova, et al., Russ. Chem Bull., Int. Ed. 61, 95 (2012).
22. A. N. Gusev, V. F. Shul'gin, S. B. Meshkova, et al., Polyhedron 47, 37 (2012).
23. B. F. Minaev, G. V. Baryshnikov, A. A. Korop, et al., Opt. Spectrosc. 113, 298 (2012).