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Structure and valence isomerization of antiaromatic molecules XI. Theoretical investigation of the valence isomerizations of cyclobutadiyne

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Literature Cited

  1. M. N. Glukhovtsev, B. Ya. Simkin, and V. I. Minkin, Zh. Org. Khim.,22, 212 (1986).

    Google Scholar 

  2. K. R. Thompson, R. L. DeKock, and W. Weltner, Jr., J. Am. Chem. Soc.,93, 4688 (1971).

    Google Scholar 

  3. P. D. Zavitsanos and G. A. Carlson, J. Chem. Phys.,59, No. 6, 2966 (1973).

    Google Scholar 

  4. L. A. Bloomfield, M. E. Geusic, R. R. Freeman, and W. L. Brown, Chem. Phys. Lett.,21, 33 (1985).

    Google Scholar 

  5. P. S. Skell, J. J. Havel, and M. M. McGlinchey, Acc. Chem. Res.,6, 97 (1973).

    Google Scholar 

  6. L. Pasternack, H. H. Nelson, and J. R. McDonald, J. Chem. Educ.,59, 456 (1982).

    Google Scholar 

  7. K. S. Pitzer and E. Clementi, J. Am. Chem. Soc.,81, 4477 (1959).

    Google Scholar 

  8. R. Hoffman, Tetrahedron,22, 521 (1966).

    Google Scholar 

  9. Z. Slanina and R. Zahradnik, J. Phys. Chem.,81, 2252 (1977).

    Google Scholar 

  10. R. A. Whiteside, R. Krishnan, D. J. DeFrees, et al., Chem. Phys. Leet.,78, 538 (1981)

    Google Scholar 

  11. R. A. Whiteside, R. Krishnan, M. J. Frisch, et al., Chem. Phys. Lett.,80, 547 (1981).

    Google Scholar 

  12. W. Kühnel, E. Gey, and H. J. Spangenberg, Z. Phys. Chem. (DDR),263, 641 (1982).

    Google Scholar 

  13. D. W. Ewing and G. V. Pfeiffer, Chem. Phys. Lett.,86, 365 (1982).

    Google Scholar 

  14. A. V. Nemukhin, A. N. Dement'ev, A. I. Kolesnikov, et al., Teor. Éksp. Khim.,19, 715 (1983).

    Google Scholar 

  15. R. M. Minyaev, Zh. Org. Khim.,17, 2486 (1981).

    Google Scholar 

  16. J. P. Ritchie, H. F. King, and W. S. Young, in: 11th Austin Symp. on Molecular Struct., Univ. of Texas at Austin, USA, March 3–5 (1986), p. 52.

  17. F. Hillenkamp and R. Nitsche, Intern. J. Mass Spectrom. Ion Phys.,31, 85 (1979).

    Google Scholar 

  18. G. W. Trucks and R. J. Bartlett, J. Mol. Struct., THEOCHEM,135, 423 (1986).

    Google Scholar 

  19. A. D. Haymet, J. Am. Chem. Soc.,108, 319 (1986).

    Google Scholar 

  20. W. A. Seitz, G. E. Hite, T. G. Schmalz, and D. J. Klein, in: 11th Austin Symp. on Molecular Struct., Univ. of Texas at Austin, USA, March 3–5 (1986), p. 57.

  21. M. N. Glukhovtsev, B. Ya. Simkin, and V. I. Minkin, 9th All-Union Conference on Quantum Chemistry. Abstracts [in Russian], Part 1, Ivanovo (1985), p. 31.

    Google Scholar 

  22. M. N. Glukhovtsev, B. Ya. Simkin, and V. I. Minkin, Zh. Org. Khim.,22, 3 (1986).

    Google Scholar 

  23. V. I. Minkin, M. N. Glukhovtsev, and B. Ya. Simkin, Zh. Org. Khim.,23 (1987).

  24. M. J. S. Dewar, S. Kirschner, and H. W. Kollmar, J. Am. Chem. Soc.,96, 5240 (1974).

    Google Scholar 

  25. M. N. Glukhovtsev, B. Ya. Simkin, and V. I. Minkin, Zh. Org. Khim.,20, 886 (1984).

    Google Scholar 

  26. M. N. Glukhovtsev, B. Ya. Simkin, and V. I. Minkin, Usp. Khim.,54, 86 (1985).

    Google Scholar 

  27. B. N. Plakhutin and G. M. Zhidomirov, Zh. Strukt. Khim.,27, No. 2, 3 (1986).

    Google Scholar 

  28. V. I. Minkin and R. M. Minyaev, Usp. Khim.,51, 586 (1982).

    Google Scholar 

  29. V. I. Minkin and R. M. Minyaev, Nonclassical Structures of Organic Compounds [in Russian], Izd. RGU, Rostov-on-Don (1985).

    Google Scholar 

  30. B. Ya. Simkin, M. N. Glukhovtsev, and V. I. Minkin, Zh. Org. Khim.,18, 1337 (1982).

    Google Scholar 

  31. W. J. Hehre, R. D. Ditchfield, and J. A. Pople, J. Am. Chem. Soc.,92, 4796 (1970).

    Google Scholar 

  32. R. Pearson, Symmetry Rules in Organic Reactions [Russian tranlation], Mir, Moscow (1979).

    Google Scholar 

  33. QCPE, Program 279, Indiana Univ., Bloomington, Indiana, USA.

  34. F. O. Ellison and F. M. Matheu, Chem. Phys. Lett.,10, 322 (1971).

    Google Scholar 

  35. M. N. Glukhovtsev and B. Ya. Simkin, Zh. Strukt. Khim.,26, No. 5, 168 (1985).

    Google Scholar 

  36. M. J. S. Dewar, J. A. Hashmall, and C. G. Venier, J. Am. Chem. Soc.,90, 1953 (1968).

    Google Scholar 

  37. L. Salem, Electrons in Chemical Reactions [Russian translation], Mir, Moscow (1985), pp. 96–99.

    Google Scholar 

  38. M. J. S. Dewar and H. W. Kollmar, J. Am. Chem. Soc.,97, 2933 (1975).

    Google Scholar 

  39. W. J. Bouma, D. Poppinger, and L. Radom, J. Mol. Struct., THEOCHEM,103, 209 (1983).

    Google Scholar 

  40. V. I. Minkin, B. Ya. Simkin, and R. M. Minyaev, Quantum Chemistry of Organic Compounds [in Russian], Khimiya, Moscow (1986), Chap. 1.

    Google Scholar 

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Authors
  1. M. N. Glukhovtsev
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  2. B. Ya. Simkin
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Additional information

For Communication X, see [1].

Scientific-Research Institute of Physical and Organic Chemistry, M. A. Suslov Rostov State University. Translated from Zhurnal Strukturnoi Khimii, Vol. 28, No. 6, pp. 27–33, November–December, 1987.

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Glukhovtsev, M.N., Simkin, B.Y. Structure and valence isomerization of antiaromatic molecules XI. Theoretical investigation of the valence isomerizations of cyclobutadiyne. J Struct Chem 28, 834–840 (1987). https://doi.org/10.1007/BF00745252

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  • DOI: https://doi.org/10.1007/BF00745252

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