Novel mechanistic proposal for the Dötz reaction derived from a density functional study: The chromahexatriene route

Chemical Communications

Volumn , Issue 9, 1998, Pages 999-1000

  Torrent, Maricel ^a   Duran, Miquel ^a   Solà, Miquel ^a  

^a UNIVERSITY OF GIRONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0007007081     PISSN: 13597345     EISSN: None     Source Type: Journal    
DOI: 10.1039/a709126e     Document Type: Article

References (25)

1. K. H. Dötz, Angew. Chem., Int. Ed. Engl., 1975, 14, 644.
2. K. H. Dötz, Angew. Chem., Int. Ed. Engt., 1984, 23, 587.
3. C. P. Casey in Reactive Intermediates, ed. M. Jones, Jr., and R. A. Moss, Wiley, New York, 1981, vol. 2, p. 155.
4. J. Barluenga, F. Aznar, A. Martín, S. García-Granda and E. Pérez-Carreño, J. Am. Chem. Soc., 1994, 116, 11 191.
5. E. Chelain, R. Goumont, L. Hamon, A. Parlier, M. Rudler, H. Rudler, J. C. Daran and J. Vaissermann, J. Am. Chem. Soc., 1992, 114, 8088;
6. B. A. Anderson, J. Bao, T. A. Brandvold, C. A. Challener, W. D. Wulff, Y.-C. Xu and A. L. Rheingold, J. Am. Chem. Soc., 1993, 115, 10671.
7. P. Hofmann and M. Hämmerle, Angew. Chem., Int. Ed. Engl., 1989, 28, 908;
8. P. Hofmann, M. Hämmerle and G. Unfried, New J. Chem., 1991, 15, 769.
9. M. M. Gleichmann, K. H. Dötz and B. A. Hess, J. Am. Chem. Soc., 1996, 118, 10551.
10. H. Fischer, J. Mühlemeier, R. Märkl and K. H. Dötz, Chem. Ber., 1982, 115, 1355.
11. GAUSSIAN 94, Gaussian, Inc. Pittsburg PA, 1995.
12. A. D. Becke, Phys. Rev., 1988, A38, 3098;
13. J. P. Perdew, Phys. Rev., 1986, B33, 8822;
14. Phys. Rev. ibid., 1986, B34, 7406E.
15. H. B. Schlegel, J. Comput. Chem., 1982, 3, 214.
16. 14 in a (62111111/3312/311) contraction scheme.
17. J. S. Binkley, J. A. Pople and W. J. Hehre, J. Am. Chem. Soc., 1980, 102, 939.
18. A. J. H. Wachters, J. Chem. Phys., 1970, 52, 1033.
19. F. Zaera, Chem. Rev., 1995, 95, 2651.
20. C. P. Casey, A. J. Shusterman, N. W. Vollendorf and K. J. Haller, J. Am. Chem. Soc., 1982, 104, 2417.
21. M. J. McGeary, T. L. Tonker and J. L. Templeton, Organometallics, 1985, 4, 2102.
22. K. H. Dötz, T. Schäfer, F. Kroll and K. Harms, Angew. Chem., Int. Ed. Engl., 1992, 31, 1236.
23. K. H. Dötz, M. Popall and G. Müller, J. Org. Chem., 1987, 334, 57.
24. F. Hohmann, S. Siemoneit, M. Nieger, S. Kotila and K. H. Dötz, Chem. Eur. J., 1997, 3, 853.
25. T. R. Tritcak, J. B. Sheridan, M. L. Cote, R. A. Lalancette and J. P. Rose, J. Chem. Soc., Dalton Trans., 1995, 6, 931.