Ab initio study of hydride abstraction reaction in the Mg +-NH2CH3 complex

Chemical Physics Letters

Volumn 381, Issue 1-2, 2003, Pages 109-116

  Guo, Wenyue ^a   Lu, Xiaoqing ^a   Hu, Songqing ^a   Yang, Shihe ^b  

^a CHINA UNIVERSITY OF PETROLEUM   (China)

^b HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Hong Kong)

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN; MAGNESIUM;

ANALYTIC METHOD; ARTICLE; CALCULATION; CHEMICAL REACTION; COMPLEX FORMATION; MOLECULAR PHYSICS; REACTION ANALYSIS;

EID: 0242333933     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2003.09.091     Document Type: Article

References (26)

1. Cronin J.R., Chang S. Greenberg J.M., Mendoza-Gómez C.X., Pirronello V. The Chemistry of Life's Origins. 1993;Kluwer Academic Publishers, Dordrecht.
2. Remko M., Šarišský M. Chem. Phys. Lett. 282:1998;227.
3. Hoyau S., Norrman K., McMahon T.B., Ohanessian G. J. Am. Chem. Soc. 121:1999;8864.
4. Deng H.T., Kebarle P. J. Am. Chem. Soc. 120:1998;2925.
5. Deng H.T., Kebarle P. J. Phys. Chem. A. 102:1998;571.
6. Pearlstine K.A., Friend C.M. J. Am. Chem. Soc. 108:1986;5837.
7. Pearlstine K.A., Friend C.M. J. Am. Chem. Soc. 108:1986;5842.
8. Vanneste A., Duce R.A., Lee C. Geophys. Res. Lett. 14:1987;711.
9. Smith D., Mclntosh B.J., Adams N.G. J. Chem. Phys. 90:1989;6213.
10. Cruz E.M., Fowler J.E., Lopez X., Ugalde J.M. J. Phys. Chem. A. 101:1997;4807.
11. Radecki B.D., Allison J. J. Am. Chem. Soc. 106:1984;946.
12. Sigsworth S.W., Castleman A.W. Jr. J. Am. Chem. Soc. 111:1989;3566.
13. Sigsworth S.W., Keesee R.G., Castleman A.W. Jr. J. Am. Chem. Soc. 110:1988;6682.
14. Chen Y.-M., Clemmer D.E., Armentrout P.B. J. Chem. Phys. 95:1991;1228.
15. Chen Y.-M., Clemmer D.E., Armentrout P.B. J. Chem. Phys. 98:1993;4929.
16. Guo W.Y., Liu H.C., Yang S.H. J. Chem. Phys. 116:2002;2896.
17. Guo W.Y., Liu H.C., Yang S.H. J. Chem. Phys. 116:2002;9690.
18. Babinec S.J., Allison J. J. Am. Chem. Soc. 106:1984;7719.
19. Becke A.D. J. Chem. Phys. 97:1992;9173.
20. Lee C., Yang W., Parra R.G. Phys. Rev. 37:1988;785.
21. Frisch M.J., Pople J.A., Binkley J.S. J. Chem. Phys. 80:1984;3265.
22. Purvis G.D., Bartlett R.J. J. Chem. Phys. 76:1982;1910.
23. Raghavachari K., Trucks G.W., Pople J.A., Head-Gordon M. Chem. Phys. Lett. 157:1989;479.
24. K.P. Huber, G. Herzberg, Molecular Spectra and Molecular Structure. IV. Constants of Diatomic Molecules, Van Nostrand Reinhold Co., New York, 1979.
25. S.G. Lias, J.E. Bartmess, J.F. Liebman, J.L. Holmes, R.D. Levin, W.G. Mallard, in: P.J. Linstrom, W.G. Mallard (Eds.), NIST Chemistry WebBook, NIST Standard Reference Database Number 69, Ion Energetics Data, National Institute of Standards and Technology, Gaithersburg MD, 20899, March 2003 Available from < http://webbook.nist.gov >.
26. Foresman J.B., Frisch Æ. Exploring Chemistry with Electronic Structure Methods. second edn. 1996;64 Gaussian, Pittsburgh.