Investigation of Markovnikov reactions of alkenes via ABEEM-σπ model

Journal of Molecular Structure: THEOCHEM

Volumn 944, Issue 1-3, 2010, Pages 105-109

  Ding, Yan Li ^a   Yang, Zhong Zhi ^b  

^a SHENYANG UNIVERSITY OF CHEMICAL TECHNOLOGY   (China)

^b LIAONING NORMAL UNIVERSITY   (China)

Author keywords

Ab initio method; ABEEM model; Electrophilic additions; Regioselectivity

Indexed keywords

EID: 76749163193     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.12.044     Document Type: Article

References (24)

1. Yang Z.Z., Ding Y.L., and Zhao D.X. Chem. Phys. Chem. 9 (2008) 2379
2. Aizman A., Contreras R., Galván M., Cedillo A., Santos J.C., and Chamorro E. J. Phys. Chem. A 106 (2002) 7844
3. Suresh C.H., Koga N., and Gadre S.R. J. Org. Chem. 66 (2001) 6883
4. Hessley R.K. J. Chem. Educ. 77 (2000) 734
5. Sæthre L.J., Thomas T.D., and Svensson S. J. Chem. Soc. Perkin. Trans. 2 (1997) 749
6. Rauk A. Orbital Interaction Theory of Organic Chemistry (1994), New York, Wiley p. 120
7. McDonald S.A., Johnson G.L., Keelan B.W., and Andrews L. J. Am. Chem. Soc. 102 (1980) 2892
8. Markovnikov V. Liebigs Ann. Chem. 153 (1870) 228
9. Pryor W.A. Free Radicals (1968), McGraw-Hill, New York
10. Parr R.G., and Yang W. Density Functional Theory of Atoms and Molecules (1989), Oxford University Press, New York
11. Hohenberg P., and Kohn W. Phys. Rev. B 136 (1964) 864
12. Kohn W., and Sham L. Phys. Rev. A 140 (1965) 1133
13. Cong Y., and Yang Z.Z. Chem. Phys. Lett. 316 (2000) 324
14. Cong Y., and Yang Z.Z. Chem. Phys. Lett. 357 (2002) 59
15. Yang Z.Z., Cong Y., and Wang C.S. Chem. J. Chin. Univ. 20 (1999) 1781
16. Sen K.D., and Jorgensen C.K. Electronegativity in Structure and Bonding vol. 66 (1987), Springer-Verlag, New York
17. Bergmann D., and Hinze J. Angew. Chem. Int. Ed. Engl. 35 (1996) 150
18. Gazquèz J.L., and Méndez F. J. Phys. Chem. 98 (1994) 4591
19. Méndez F., and Gazquèz J.L. J. Am. Chem. Soc. 116 (1994) 298
20. Li Y., and Evans J.N.S. J. Am. Chem. Soc. 117 (1995) 7756
21. Pearson R.G. J. Chem. Educ. 64 (1987) 561
22. Parr R.G., and Chattaraj P.K. J. Am. Chem. Soc. 113 (1991) 1854
23. Kar T., and Scheiner S. J. Phys. Chem. 99 (1995) 8121
24. Chattaraj P.K., Nath S., and Sannigrahi A.B. Chem. Phys. Lett. 212 (1993) 223