"Thermochemical mimicry" of phenyl and vinyl groups: Can it be extended to charged species?

International Journal of Mass Spectrometry

Volumn 179-180, Issue , 1998, Pages 261-266

  Hunter, Edward P ^a   Lias, Sharon G ^a   Rooney, Christopher M ^b   Winstead, John L ^b   Liebman, Joel F ^b  

^a NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

^b UNIVERSITY OF MARYLAND BALTIMORE COUNTY   (United States)

Author keywords

Enthalpy of formation; Ionization energies; Proton affinities; Substituent effects

Indexed keywords

EID: 0347571984     PISSN: 13873806     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1387-3806(98)14068-X     Document Type: Article

References (10)

1. (a) J.F. Liebman, in Molecular Structure and Energetics: Studies of Organic Molecules, J.F. Liebman, A. Greenberg (Eds.), VCH, Deerfield Beach, 1986, p. 267;
2. (b) P. George, C.W. Bock, M. Trachtman, in Molecular Structure and Energetics: Biophysical Aspects, J.F. Liebman, A. Greenberg (Eds.), VCH, New York, 1987, p. 163;
3. (c) Y.-R. Luo, J.L. Holmes, J. Phys. Chem. 96 (1992) 568;
4. (d) Y.-R. Luo, J.L. Holmes, J. Phys. Org. Chem. 7 (1994) 403.
5. S.W. Benson, Chem. Rev. 78 (1978) 23.
6. See, for example, (a) S.W. Slayden, J.F. Liebman, W.G. Mallard, in The Chemistry of Functional Groups, Supplement D2: The Chemistry of Organic Halides, Pseudohalides and Azides, S. Patai, Z. Rappoport (Eds.), Wiley, Chichester, UK, 1995, p. 361; (b) J.F. Liebman, H. Afeefy, Thermodynamical Modeling and Materials Data Engineering, J.-P. Caliste, E. Truyol, J. Westbrook (Eds.), Springer, to be published.
7. See, for example, (a) S.W. Slayden, J.F. Liebman, W.G. Mallard, in The Chemistry of Functional Groups, Supplement D2: The Chemistry of Organic Halides, Pseudohalides and Azides, S. Patai, Z. Rappoport (Eds.), Wiley, Chichester, UK, 1995, p. 361; (b) J.F. Liebman, H. Afeefy, Thermodynamical Modeling and Materials Data Engineering, J.-P. Caliste, E. Truyol, J. Westbrook (Eds.), Springer, to be published.
8. E.P.L. Hunter, S.G. Lias, J. Phys. Chem. Ref. Data, to be published.
9. 2, respectively; cf. R.A.L. Peerboom, S. Ingemann, N.M.M. Nibbering, J.F. Liebman, J. Chem. Soc. Perkin Trans. 2 (1990) 1825.
10. · because all of its protonated species may be understood as the radical cation formed by formal loss of an oxygen lone pair electron from some hydroxylic (ROH: phenol, enol, alcohol, water) species.