An evaluation of additivity schemes for the estimation of heats of formation of distonic radical cations

Acta Chemica Scandinavica

Volumn 51, Issue 5, 1997, Pages 641-645

  Gauld, James W ^a   Holmes, John L ^b   Radom, Leo ^a  

^a AUSTRALIAN NATIONAL UNIVERSITY   (Australia)

^b UNIVERSITY OF OTTAWA   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001434863     PISSN: 0904213X     EISSN: None     Source Type: Journal    
DOI: 10.3891/acta.chem.scand.51-0641     Document Type: Review

References (28)

1. Lias, S. G., Bartmess, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D. and Mallard, W. G. J. Phys. Chem. Ref. Data, Suppl. 17 (1988) 1.
2. Holmes, J. L., Fingas, M. and Lossing, F. P. Can. J. Chem. 59 (1981) 80.
3. Holmes, J. L., Lossing, F. P., Terlouw, J. K. and Burgers, P. C. J. Am. Chem. Soc. 104 (1982) 2931.
4. Holmes, J. L. and Lossing, F. P. Int. J. Mass Spectrom. Ion Proc. 92 (1989) 111.
5. Holmes, J. L. Adv. Mass Spectrom. 11 (1989) 53.
6. Hammerum, S. Mass Spectrom. Rev. 7 (1988) 123.
7. Kenttämaa, H. I. Org. Mass Spectrom. 29 (1994) 1.
8. Benoit, F. M., Harrison, A. G. and Lossing, F. P. Org. Mass Spectrom. 12 (1977) 78.
9. Wesdemiotis, C., Danis, P. O., Feng, R., Tso, J. and McLafferty, F. W. J. Am. Chem. Soc. 107 (1985) 8059.
10. Mourgues, P., Audier, H. E., Leblanc, D. and Hammerum, S. Org. Mass Spectrom. 28 (1993) 1098.
11. Hehre, W. J., Radom, L., Schleyer, P. v. R. and Pople, J. A. Ab Initio Molecular Orbital Theory, Wiley, New York 1986.
12. Frisch, M. J., Trucks, G. W., Schlegel, H. B., Gill, P. M. W., Johnson, B. G., Wong, M. W., Foresman, J. B., Robb, M. A., Head-Gordon, M., Replogle, E. S., Gomperts, R., Andres, J. L., Raghavachari, K., Binkley, J. S., Gonzalez, C., Martin, R. L., Fox, D. J., DeFrees, D. J., Baker, J., Stewart, J. J. P. and Pople, J. A. GAUSSIAN 92/DFT, Gaussian Inc., Pittsburgh, PA 1993.
13. Frisch, M. J., Trucks, G. W., Schlegel, H. B., Gill, P. M. W., Johnson, B. G., Robb, M. A., Cheeseman, J. R., Keith, T. A., Petersson, G. A., Montgomery, J. A., Raghavachari, K., Al-Laham, M. A., Zakrzewski, V. G., Ortiz, J. V., Foresman, J. B., Cioslowski, J., Stefanov, B. B., Nanayakkara, A., Challacombe, M., Peng, C. Y., Ayala, P. Y., Chen, W., Wong, M. W., Andres, J. L., Replogle, E. S., Gomperts, R., Martin, R. L., Fox, D. J., Binkley, J. S., DeFrees, D. J., Baker, J., Stewart, J. P., Head-Gordon, M., Gonzalez, C. and Pople, J. A. GAUSSIAN 94, Gaussian Inc., Pittsburgh, PA 1995.
14. Curtiss, L. A., Raghavachari, K. and Pople, J. A. J. Chem. Phys. 98 (1993) 1293.
15. Smith, B. J. and Radom, L. J. Phys. Chem. 99 (1995) 6468.
16. Curtiss, L. A., Redfern, P. C., Smith, B. J. and Radom, L. J. Chem. Phys. 104 (1996) 5148.
17. Curtiss, L. A., Jones, C., Trucks, G. W., Raghavachari, K. and Pople, J. A. J. Chem. Phys. 94 (1991) 7221.
18. Nicolaides, A., Rauk, A., Glukhovtsev, M. N. and Radom, L. J. Phys. Chem. 100 (1996) 17460.
19. Holmes, J. L., Lossing, F. P. and Mayer, P. M. J. Am. Chem. Soc. 113 (1991) 9723.
20. Dobe, S. Z. Phys. Chem. 175 (1992) 123.
21. Ruscic, B. and Berkowitz, J. J. Phys. Chem. 97 (1993) 11451.
22. Espinosa-García, J. and Olivares del Valle, F. J. J. Phys. Chem. 97 (1993) 3377.
23. Traeger, J. C. and Holmes, J. L. J. Phys. Chem. 97 (1993) 3453.
24. Kuo, S., Zhang, Z., Klemm, R. B., Liebman, J. F., Stief, L. J. and Nesbitt, F. L. J. Phys. Chem. 98 (1994) 4026.
25. Holmes, J. L. and Lossing, F. P. Can. J. Chem. 60 (1982) 2365.
26. Yates, B. F., Bouma, W. J. and Radom, L. Tetrahedron 42 (1986) 6225.
27. Radom, L. Prog. Theor. Org. Chem. 3 (1981) 1.
28. Boyd, S. L., Boyd, R. J., Bessonette, P. W., Kerdraon, D. I. and Aucoin, N. T. J. Am. Chem. Soc. 117 (1995) 8816.