Thermochemistry of HgCH3 and HgCH3+ and the ionization energy of HgCH3

Chemical Physics Letters

Volumn 376, Issue 3-4, 2003, Pages 418-423

  Lee, Edmond P F ^a,b   Wright, Timothy G ^c  

^a UNIVERSITY OF SOUTHAMPTON   (United Kingdom)

^b HONG KONG POLYTECHNIC UNIVERSITY   (Hong Kong)

^c UNIVERSITY OF SUSSEX   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CATION; MERCURY DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CHEMICAL BINDING; CHEMICAL INTERACTION; ENERGY; GEOMETRY; HEAT; IONIZATION; RAMAN SPECTROMETRY; VIBRATION;

EID: 0141450243     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(03)01022-4     Document Type: Article

References (16)

1. Corbeil M.C., Beauchamp A.L., Alex S., Savoie R. Can. J. Chem. 64:1986;1876.
2. Tajmirriahi H.A., Langlais M., Savoie R. Biochim. Biophys. Acta. 956:1988;211.
3. Stone J.A., Splinter D.E. Can. J. Chem. 59:1981;1779.
4. Yamamjoto R., Sumino K., Nakamae K. Arch. Toxicol. 69:1994;127.
5. Simpson R.B. J. Am. Chem. Soc. 86:1964;2059.
6. Cerny T., Tan X.Q., Williamson J.M., Robles E.S.J., Ellis A.M., Miller T.A. J. Chem. Phys. 99:1993;9376.
7. Panov S.I., Powers D.E., Miller T.A. J. Chem. Phys. 108:1998;1335.
8. Barckholtz T.A., Powers D.E., Miller T.A., Bursten B.E. J. Am. Chem. Soc. 121:1999;2576.
9. Sinha S.P. Inorg. React. Mech. 2:2000;33.
10. M.J. Frisch et al., GAUSSIAN 98, Gaussian Inc., Pittsburgh, PA, 1999.
11. Soldán P., Lee E.P.F., Wright T.G. J. Phys. Chem. A. 106:2002;8619.
12. MOLPRO is a package of ab initio programs written by H.-J. Werner, P.J. Knowles, with contributions from J. Almlöf, R.D. Amos, A. Berning, M.J.O. Deegan, F. Eckert, S.T. Elbert, C. Hampel, R. Lindh, W. Meyer, A. Nicklass, K. Peterson, R. Pitzer, A.J. Stone, P.R. Taylor, M.E. Mura, P. Pulay, M. Schuetz, H. Stoll, T. Thorsteinsson, D.L. Cooper.
13. Blush J.A., Chen P., Wiedmann R.T., White M.G. J. Chem. Phys. 98:1993;3557.
14. M.W. Chase Jr., NIST-JANAF Themochemical Tables, fourth ed., J. Phys. Chem. Ref. Data Monograph 9 (1998).
15. Cited on webbook.nist.gov as personal communication from J.A. Martinho Simões.
16. Lias S.G., Bartmess J.E., Liebman J.F., Holmes J.L., Levin R.D., Mallard W.G. J. Phys. Chem. Ref. Data Supp. 1:1988;17.