A comparative AIM study of alkyl monoethers and their protonated forms

Chemical Physics Letters

Volumn 332, Issue 5-6, 2000, Pages 474-480

  Vila, A ^a   Mosquera, R A ^a  

^a UNIVERSITY OF VIGO   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0034731173     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)01323-3     Document Type: Article

References (31)

1. [1] J.C. Guillemin, M. Decouzon, P.C. Maria, J.F. Gal, O. Mó, M. Yañez, J. Phys. Chem. A 101 (1997) 9225.
2. [2] G. Chambaud, P. Rosmus, M.L. Senent, P. Palmieri, Mol. Phys. 92 (1997) 399.
3. [3] J.P. Richard, G. Williams, J. Gao, J. Am. Chem. Soc. 121 (1999) 715.
4. [4] J.K. Wolken, F. Turecek, J. Am. Chem. Soc. 121 (1999) 6010.
5. [5] A. González, O. Mó, M. Yãnez, J. Phys. Chem. A 103 (1999) 1662.
6. [6] S. Hammerum, T.I. Sollin, J. Am. Chem. Soc. 121 (1999) 6002.
7. [7] S.G. Lias, J.F. Liebman, R.D. Levin, J. Phys. Chem. Ref. Data 13 (1984) 695.
8. [8] S.G. Lias, J.E. Bartmess, J.F. Liebman, J.L. Holmes, R.D. Levin, J. Phys. Chem. Ref. Data 14 (Suppl. 1) (1988).
9. [9] R.F.W. Bader, Atoms in Molecules, A Quantum Theory; International Series of Monographs in Chemistry, No 22, Oxford University Press, Oxford, 1990.
10. [10] A. Vila, E. Carballo, R.A. Mosquera, Can. J. Chem. (2000) in press.
11. [11] R.F.W. Bader, P.L.A. Popelier, C. Chang, J. Mol. Struct. (THEOCHEM) 255 (1992) 145.
12. [12] J. Cioslowski, B.B. Stefanov, P. Constans, J. Comput. Chem. 17 (1996) 1352.
13. [13] M. Hô, V.H. Smith Jr., D.F. Weaver, C. Gatti, R.P. Sagar, R.O. Esquivel, J. Chem. Phys. 108 (1998) 5469.
14. [14] R.F.W. Bader, P.L.A. Popelier, T.A. Keith, Angew. Chem. Int. Ed. Engl. 33 (1994) 620.
15. [15] R.F.W. Bader, F. Martín, Can. J. Chem. 76 (1998) 284.
16. [16] P.L.A. Popelier, R.F.W. Bader, J. Phys. Chem. 98 (1994) 4473.
17. [17] B.B. Stefanov, J. Cioslowski, Can. J. Chem., 74 (1996) 1263.
18. [18] A.M. Graña, R.A. Mosquera, J. Chem. Phys. 110 (1999) 6606.
19. [19] J. Cioslowski, G. Liu, P. Piskorz, J. Phys. Chem. A 102 (1998) 9890.
20. [20] J. Hernández-Trujillo, R.F.W. Bader, J. Phys. Chem. A 104 (2000) 1779.
21. [21] A.M. Graña, R.A. Mosquera, Chem. Phys. 243 (1999) 17.
22. [22] R.F.W. Bader, coworkers (Eds.), AIMPAC: A Suite of Programs for the Theory of Atoms in Molecules, McMaster University, Hamilton, Ont., Canada, L8S 4M1. Contact bader@mcmail.cis.mcmaster ca.
23. [23] Gaussian 94, Revision C.3, M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, J. Cioslowski, B.B. Stefanov, A. Nanayakkara, M. Challacombe, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, S. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzalez, J.A. Pople, Gaussian, Pittsburgh, PA, 1995.
24. [24] S.G.L. Hunter, in: W.G. Mallard, P.J. Linstrom (Eds.), Proton Affinity Evaluation, NIST Chemistry Webbook, NIST Standard Reference Database Number 69, March 1998, National Institute of Standards and Technology, Gaithersburg MD, 20899 http://webbook.nist.gov.
25. [25] N.C.J. Stutchbury, D.L. Cooper, J. Chem. Phys. 79 (1983) 4967.
26. [26] R.F.W. Bader, Can. J. Chem. 64 (1986) 1036.
27. [27] W.J. Hehre, M. Taagepera, R.W. Taft, R.D. Topsom, J. Am. Chem. Soc. 103 (1981) 1344.
28. [28] D. Cremer, E. Kraka, Croat. Chem. Acta 57 (1984) 1259.
29. [29] S.F. Smith, J. Chandrasekar, W.L. Jorgensen, J. Phys. Chem. 82 (1982) 3308.
30. [30] C. Glidewell, C. Thomson, J. Comput. Chem. 3 (1982) 495.
31. [31] J.L.M. Abboud, J. Elguero, D. Liotard, M.H. Essefard, M.E. Mouthadi, R.W. Taft, J. Chem. Soc., Perkin Trans. 2 (1990) 565.