Quantum chemical study of the intramolecular transfer of hydrogen in o-methylacetophenone and 1-alkylanthraquinones

Journal of Structural Chemistry

Volumn 38, Issue 4, 1997, Pages 536-543

  Leonenko, Z V ^a   Gritsan, N P ^a  

^a NOVOSIBIRSK STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 27344447130     PISSN: 00224766     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02762734     Document Type: Article

References (24)

1. T. Dziembowska, Polish J., 68, No. 8, 1455-1489 (1994).
2. N. P. Gritsan and L. S. Klimenko, J. Photochem. Photobiol A. Chem., 70, 103-117 (1993).
3. W. Klopffer, Adv. Photochem., 10, 311-358 (1977).
4. L. S. Klimenko, I. Ya. Mainagashev, Z. V. Leonenko, and N. P. Gritsan, Izv. Ross. Akad. Nauk, 10, 1988-1994 (1995).
5. N. P. Gritsan, E. M. Shvartsberg, V. V. Russkikh, and I. V. Khmelinskii, Zh. Fiz. Khim., 64, No. 11, 3081-3086 (1990).
6. N. P. Gritsan, I. V. Khmelinskii, and O. M. Usov, J. Am. Chem. Soc., 113, No. 25, 9615-9620 (1991).
7. A. A. Bliznyuk and A. A. Voityuk, Zh. Strukt. Khim., 27, No. 4, 190-191 (1986).
8. M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc., 99, No. 15, 4899-4907 (1977).
9. M. J. S. Dewar, E. G. Zoebisch, E. F. Healy, and J. J. P. Stewart, J. Am. Chem. Soc., ibid., 107, 3902-3909 (1985).
10. J. J. P. Stewart, J. Comput. Chem., 10, 209-220 (1989).
11. A. A. Bliznyuk and A. A. Voityuk, Zh. Strukt. Khim., 29, No. 2, 31-37 (1988).
12. J. Dennis and R. Schnabel, Numerical Methods for Unconditional Optimization and Solving Nonlinear Equations [Russian translation], Mir, Moscow (1988), pp. 416-420.
13. J. Baker, J. Comput. Chem., 7, No. 4, 385-395 (1986).
14. U. Burkert and N. L. Allinger (eds.), Molecular Mechanics, ACS Monograph No. 177, American Chemical Society, Washington, D.C. (1982).
15. A. A. Voityuk, Zh. Strukt. Khim., 24, No. 3, 18-22 (1983).
16. K. Ya. Burshtein, Zh. Strukt. Khim., ibid., 28, No. 2, 3-9 (1987).
17. S. L. Baughcum, R. W. Duerst, W. F. Rowe, et al., J. Am. Chem. Soc., 103, 6296-6303 (1981).
18. Yu. S. Bogachev, N. N. Shapetko, and D. N. Shigorin, Zh. Strukt. Khim., 20, No. 2, 282-288 (1979).
19. S. L. Baughcum, Z. Smith, E. B. Wilson, and R. W. Duerst, J. Am. Chem. Soc., 106, 2260-2265 (1984).
20. P. Turner, S. L. Baughcum, S. L. Coy, and Z. Smith, J. Am. Chem. Soc., ibid., 106, 2265-2267 (1984).
21. J. Bicerano, H. F. Schaefer, and W. H. Miller, J. Am. Chem. Soc., ibid., 105, No. 9, 2550-2553 (1983).
22. M. A. Rios and S. Rodriguez, J. Comput. Chem., 13, 860-866 (1992).
23. S. Rodriguez, J. Comput. Chem., ibid., 15, 183-189 (1994).
24. R. Haag, J. Wirz, and P. Wagner, Helv. Chim. Acta, 60, 2595-2607 (1977).