Unusual, bifurcated photoreactivity of a rhenium(I) carbonyl complex of triethynylphosphine

Inorganic Chemistry

Volumn 44, Issue 26, 2005, Pages 9601-9603

  Hightower, Sean E ^a   Corcoran, Robert C ^a   Sullivan, B Patrick ^a  

^a UNIVERSITY OF WYOMING   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 31044440236     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic050901e     Document Type: Article

References (16)

1. Voskuil, W.; Arens, J. F. Recl. Trav. Chim. Pays-Bas 1964, 83, 1301.
2. Koike, K.; Okoshi, N.; Hori, H.; Takeuchi, K.; Ishitani, O.; Tsubaki, H.; Clark, I. P.; George, M. W.; Johnson, F. P. A.; Turner, J. J. J. Am. Chem. Soc. 2002, 124, 11448.
3. Woessner, S. M.; Helms, J. B.; Lantzky, K. M.; Sullivan, B. P. Inorg. Chem. 1999, 38, 4378.
4. C≡C 2052.
5. (a) Tsubaki, H.; Tohyama, S.; Koike, K.; Hideki, S.; Ishitani, O. Dalton Trans. 2005, 2, 385-395.
6. (b) Del Negro, A. Ph.D. dissertation, University of Wyoming, Laramie, WY, 2004.
7. Coe, B. J.; Glenwright, S. J. Coord. Chem. Rev. 2000, 203, 5.
8. Shaver, R. J.; Rillema, D. P. Inorg. Chem. 1992, 31, 410.
9. Koike, K.; Tanabe, J.; Toyama, S.; Tsubaki, H.; Sakamoto, K.; Westwell, J. R.; Johnson, F. P. A.; Hori, H.; Saitoh, H.; Ishitani, O. Inorg. Chem. 2000, 39, 2777-2783.
10. -1): ν(CO) 1969, 1900.
11. -1): ν(CO) 1951, 1879.
12. Stor, G. J.; Hartl, F.; van Outersterp, J. W. M.; Stufkens, D. J. Organometallics 1995, 14, 1115-1131.
13. The electronic ground state and geometry optimization were carried out using the B3LYP approximation, followed by a TDDFT calculation of the lowest excited states employing the same functional. The calculations utilized the 6-31G* basis set for the ligands and the LANL2 relativistic effective core potential for the transition metal. PCM calculations were employed to produce a number of singlet and triplet excited states of complex 1 in methylene chloride and acetonitrile based on the singlet/triplet ground-state geometry optimized in the gas phase. The self-consistent reaction field CPCM was implemented.
14. Cossi, M.; Barone, V. J. Chem. Phys. 2001, 115, 4708.
15. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; et al. Gaussian03, revision C.02; Gaussian, Inc.: Wallingford, CT, 2004.
16. Paterson, M. J.; Hunt, P. A.; Takahashi, O.; Robb, M. A. J. Phys. Chem. A 2002, 106, 10494-10504.