Analysis of the vibrational spectra, force fields, and molecular structures of pentacarbonyl(methyl)manganese(I) and pentacarbonyl(methyl)rhenium(I)

Journal of Organometallic Chemistry

Volumn 616, Issue 1-2, 2000, Pages 1-9

  Bencze, E ^a   Mink, J ^a,b   Papai I ^a   Butler, I S ^c   Lafleur, D ^c   Gilson, D F R ^c  

^a CHEMICAL RESEARCH CENTER   (Hungary)

^b UNIVERSITY OF PANNONIA   (Hungary)

^c MCGILL UNIVERSITY   (Canada)

Author keywords

Density functional theory; FT Raman spectroscopy; FTIR; Manganese and rhenium; Normal coordinate analysis

Indexed keywords

EID: 0011196909     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-328X(00)00512-X     Document Type: Article

References (37)

1. J.B. Wilford, F.G.A. Stone, Inorg. Chem. 4 (1965) 389.
2. H.D. Kaesz, R. Bau, D. Hendrickson, J.M. Smith, J. Am. Chem. Soc. 89 (1967) 2844.
3. F.A. Cotton, A. Musco, G. Yagupsky, Inorg. Chem. 6 (1967) 1357.
4. R.W. Cattrall, R.J.H. Clark, J. Organomet. Chem. 6 (1966) 167.
5. O. Kahn, M. Bigorgne, C. R. Acad. Sci. Ser. C 266 (1968) 792.
6. W. Hieber, G. Braun, W. Beck, Chem. Ber. 93 (1960) 901.
7. A.B. Dempster, D.B. Powell, N. Sheppard, J. Chem. Soc. A (1970) 1129.
8. M.A. Andrews, J. Eckert, J.A. Goldstone, L. Passell, B. Swanson, J. Am. Chem. Soc. 105 (1983) 2262.
9. C. Long, A.R. Morrisson, D.C. McKean, G.P. McQuillan, J. Am. Chem. Soc. 106 (1984) 7418.
10. G.P. McQuillan, D.C. McKean, C. Long, A.R. Morrisson, I. Torto, J. Am. Chem. Soc. 108 (1986) 863.
11. Y. Huang, I.S. Butler, D.F.R. Gilson, D. Lafleur, Inorg. Chem. 30 (1991) 117.
12. D.J. Mafleur, M.Sc. Thesis, McGill University, Montreal, 1988.
13. T.M. McHugh, A.J. Rest, J. Chem. Soc. Dalton Trans. (1980) 2323.
14. I.S. Butler, D.F.R. Gilson, D. Lafleur, Appl. Spectrosc. 46 (1992) 1605.
15. D. Lafleur, Y Huang, D.F.R. Gilson, I.S. Butler, J. Solid State Chem. 108 (1994) 99.
16. J. Gang, M. Pennington, D.K. Russell, P.B. Davies, G.M. Hansford, N.A. Martin, J. Chem. Phys. 97 (1992) 3885.
17. D.K. Ottesen, H.B. Gray, L.H. Jones, M. Goldblatt, Inorg. Chem. 12 (1973) 1051.
18. J. Mink, W.P. Felhammer, K. Bar, unpublished results.
19. H.M. Seip, R. Seip, Acta Chem. Scand. 24 (1970) 3431.
20. D.W.H. Rankin, A. Robertson, J. Organomet. Chem. 105 (1976) 331.
21. J. Mink, L.M. Mink, Computer Program System for Vibrational Analysis of Molecules, University of Erlangen, Erlangen, 1983.
22. P.L. Goggin, G. Kemény, J. Mink, J. Chem. Soc. Faraday 72 (1976) 1025.
23. A.D. Becke, Phys. Rev. A 38 (1988) 3098.
24. J.P. Perdew, Phys. Rev. B 33 (1986) 8822 Erratum in: Phys. Rev. B 38 (1986) 7406.
25. N. Godbout, J. Andzelm, D.R. Salahub, E. Wimmer, Can. J. Chem. 70 (1992) 560.
26. F. Sim, D.R. Salahub, S. Chin, M. Dupuis, J. Chem. Phys. 95 (1991) 4317.
27. D.R. Salahub, R. Fournier, P. Mlynarski, I. Pápai, A. St-Amant, J. Ushio, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991.
28. A. St-Amant, Ph.D. Thesis, Université de Montréal, 1991.
29. A. St-Amant, D.R. Salahub, Chem. Phys. Lett. 169 (1990) 387.
30. I. Pápai, J. Chem. Phys. 103 (1995) 1860.
31. L.H. Jones, R.S. McDowell, M. Goldblatt, Inorg. Chem. 8 (1969) 2349.
32. R.A.N. McLean, Can. J. Chem. 52 (1974) 213.
33. A. Wojcicki, M.F. Farona, J. Inorg. Nucl. Chem. 26 (1964) 2289.
34. E.W. Abel, R.A.N. McLean, S.P. Tyfield, P.S. Braterman, A.P. Walker, J. Mol. Spectrosc. 30 (1969) 29.
35. F.A. Cotton, C.S. Kraihanzel, J. Am. Chem. Soc. 84 (1962) 4432.
36. J. Mink, G. Keresztury, A. Stirling, W.A. Herrmann, Spectrochim. Acta 50A (1994) 2039.
37. J.L. Duncan, Spectrochim. Acta 20 (1964) 1197.