A density functional theory study of dinitrogen bonding in ruthenium complexes

Journal of Organometallic Chemistry

Volumn 673, Issue 1-2, 2003, Pages 56-66

  Ben Said, Ridha ^a   Hussein, Khansaa ^b,d   Tangour, Bahoueddine ^a   Sabo Etienne, Sylviane ^c   Barthelat, Jean Claude ^b  

^a UNIVERSITÉ DE CARTHAGE   (Tunisia)

^b European Theoretical Spectroscopy Facility   (France)

^c LCC LABORATOIRE DE CHIMIE DE COORDINATION   (France)

^d University of Al Baath   (Syrian Arab Republic)

Author keywords

DFT calculations; Dihydrogen complexes; Dinitrogen complexes; Ruthenium

Indexed keywords

LIGAND; NITROGEN DERIVATIVE; PHOSPHINE DERIVATIVE; RUTHENIUM; RUTHENIUM COMPLEX;

ARTICLE; CALCULATION; CHEMICAL ANALYSIS; CHEMICAL BINDING; CHEMICAL BOND; CONTROLLED STUDY; DENSITY; ELECTRON; ENERGY; GEOMETRY; ISOMER; MOLECULAR STABILITY; PARAMETER; THEORY; TRANS ISOMER; VIBRATION;

SUS SCROFA;

EID: 0038417867     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-328X(03)00157-8     Document Type: Article

References (29)

1. Leigh G.J. Winterton N. Modern Coordination Chemistry, the Legacy of Joseph Chatt 2002 RSC UK sections E and F.
2. Allen A.D. Senoff C.V. Chem. Comm. 1965 621.
3. Fryzuk M.D. Johnson S.A. Coord. Chem. Rev. 200-202 2000 379.
4. Hidai M. Mizobe Y. Chem. Rev. 95 1995 1115.
5. Gambarotta S. J. Organomet. Chem. 500 1995 117.
6. Jessop P.G. Morris R.H. Coord. Chem. Rev. 121 1992 155.
7. Kubas G.J. Metal Dihydrogen and σ-Bond Complexes 2001 Kluwer Academic/Plenum Publishers New York
8. Sabo-Etienne S. Chaudret B. Coord. Chem. Rev. 178-180 1998 381.
9. Montiel-Palma V. Lumbierres M. Donnadieu B. Sabo-Etienne S. Chaudret B. J. Am. Chem. Soc. 124 2002 5624 references therein.
10. Atheaux I. Delpech F. Donnadieu B. Sabo-Etienne S. Chaudret B. Hussein K. Barthelat J.-C. Braun T. Duckett S.B. Perutz R.N. Organometallics 21 2002 5347.
11. Rodriguez V. Sabo-Etienne S. Chaudret B. Thoburn J. Ulrich S. Limbach H.-H. Eckert J. Barthelat J.-C. Hussein K. Marsden C.J. Inorg. Chem. 37 1998 3475.
12. A.F. Borowski, B. Donnadieu, J.-C. Daran, S. Sabo-Etienne, B. Chaudret, Chem. Commun. (2000) 543.
13. A.F. Borowski, B. Donnadieu, J.-C. Daran, S. Sabo-Etienne, B. Chaudret, Chem. Commun. (2000) 1697.
14. Sabo-Etienne S. Hernandez M. Chung G. Chaudret B. New J. Chem. 18 1994 175.
15. Christ M.L. Sabo-Etienne S. Chung G. Chaudret B. Inorg. Chem. 33 1994 5136.
16. Abdur-Rashid K. Gusev D.G. Lough A.J. Morris R.H. Organometallics 19 2000 1652.
17. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, P. Salvador, J.J. Dannenberg, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, gaussian 98, Revision A.11, Gaussian, Inc., Pittsburgh PA, 2001.
18. Becke A.D. J. Chem. Phys. 98 1993 5648.
19. Lee C. Yang W. Parr R.G. Phys. Rev. B 37 1988 785.
20. Hussein K. Marsden C.J. Barthelat J.-C. Rodriguez V. Conejero S. Sabo-Etienne S. Donnadieu B. Chaudret B. Chem. Commun. 1999 1315.
21. Delpech F. Sabo-Etienne S. Daran J.C. Chaudret B. Hussein K. Marsden C.J. Barthelat J.-C. J. Am. Chem. Soc. 121 1999 6668.
22. Atheaux I. Donnadieu B. Rodriguez V. Sabo-Etienne S. Chaudret B. Hussein K. Barthelat J.-C. J. Am. Chem. Soc. 122 2000 5664.
23. Durand P. Barthelat J.-C. Theor. Chim. Acta 38 1975 283.
24. Bouteiller Y. Mijoule C. Nizam M. Barthelat J.-C. Daudey J.-P. Pélissier M. Silvi B. Mol. Phys. 65 1988 2664.
25. Reed A.E. Curtiss L.A. Weinhold F. Chem. Rev. 88 1988 899.
26. K. Hussein, Ph.D. Thesis, Université Paul Sabatier, Toulouse, France, 2000.
27. Xantheas S.S. J. Chem. Phys. 104 1996 8821.
28. Radius U. Bickelhaupt F.M. Ehlers A.W. Goldberg N. Hoffmann R. Inorg. Chem. 37 1998 1080.
29. Kovacs A. Frenking G. Organometallics 20 2001 2510.