Reaction pathways of 2,2,2-trifluoroethylamine and n-butylamine with [Ru(bpy)2(NO)Cl]2+

The reaction of [Ru(bpy)2(NO)Cl]2+ with 2,2,2-trifluoroethylamine produced [Ru(bpy)2(NO)Cl]+ by electron transfer and a number of organic compounds formed via nucleophilic substitution of the intermediate 2,2,2-trifluoroethyldiazonium ion (free or coordinated). Density functional theory computed res...

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Autor principal: Di Salvo, F.
Otros Autores: Crespo, A., Estrin, D.A, Doctorovich, F.
Formato: Capítulo de libro
Lenguaje:Inglés
Publicado: 2002
Acceso en línea:Registro en Scopus
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Registro en la Biblioteca Digital
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100 1 |a Di Salvo, F. 
245 1 0 |a Reaction pathways of 2,2,2-trifluoroethylamine and n-butylamine with [Ru(bpy)2(NO)Cl]2+ 
260 |c 2002 
506 |2 openaire  |e Política editorial 
504 |a Doctorovich, F., Escola, N., Trápani, C., Estrin, D.A., Turjanski, A.G., González Lebrero, M.C., (2000) Organometallics, 19, p. 3810 
504 |a Mohrig, J.R., Keegstra, K., (1967) J. Am. Chem. Soc., 89, p. 5492 
504 |a Berner, D., McGarrity, J.F., (1979) J. Am. Chem. Soc., 101, p. 3135 
504 |a Herrmann, W.A., Biersack, H., (1977) Chem. Ber., 110, p. 896 
504 |a Diamantis, A.A., Chatt, J., Leigh, J.G., Heath, G.A., (1975) J. Organomet. Chem., 84, p. C11 
504 |a Hillhouse, G.L., Haymore, B.L., Herrmann, W.A., (1979) Inorg. Chem., 18, p. 2423 
504 |a Casey, C.P., Widenhoefer, R.A., Hayashi, R.K., (1995) Inorg. Chem., 34, p. 2258 
504 |a Bowden, W.L., Little, W.F., Meyer, T.J., (1977) J. Am. Chem. Soc., 99, p. 4340 
504 |a Li, J., Noodleman, L., Case, D.A., Electronic Structure Calculations: Density Functional Methods with Applications to Transition Metal Complexes (1999) Inorganic Structure and Spectroscopy, , E.I. Solomon, & B.P. Lever. New York: Wiley 
504 |a Deeth, R.J., (1995) Computational Modeling of Transition Metal Centers. Structure and Bonding, 82. , Berlin: Springer 
504 |a Cramer, C.J., Truhlar, D.G., (1994) Quantitative Treatments of Solute/Solvent Interactions, , P. Politzer, & J.S. Murray. New York: Elsevier 
504 |a Ho, L.L., MacKerell, A.D., Bash, P.A., (1996) J. Phys. Chem., 100, p. 4466 
504 |a Estrin, D.A., Baraldo, L.M., Slep, L.D., Barja, B.C., Olabe, J.A., (1996) Inorg. Chem., 35, p. 3897 
504 |a Hamra, O.Y., Slep, L.D., Olabe, J.A., Estrin, D.A., (1998) Inorg. Chem., 37, p. 2033 
504 |a Estrin, D.A., Hamra, O.Y., Paglieri, L., Slep, L.D., Olabe, J.A., (1996) Inorg. Chem., 35, p. 6832 
504 |a Doctorovich, F., Trápani, C., (1999) Tetrahedron Lett., 40, p. 4635 
504 |a Ho, J., Fishbein, J.C., (1994) J. Am. Chem. Soc., 116, p. 6611 
504 |a Callahan, R.W., Meyer, T.J., (1977) Inorg. Chem., 3, p. 16 
504 |a Eggleston, D.S., Goldsby, K.A., Hodgson, D.J., Meyer, T.J., (1985) Inorg. Chem., 24, p. 4573 
504 |a Clear, J.M., Kelly, J.M., O'Connel, C.M., Vos, J.G., Cardin, C.J., Costa, S.R., Edwards, A.J., (1980) J. Chem. Soc., Chem. Commun., p. 750 
504 |a Nagao, H., Nishimura, H., Funato, H., Ichikawa, Y., Howell, F.S., Mukaida, M., Kakihana, H., (1989) Inorg. Chem., 28, p. 3955 
504 |a Estrin, D.A., Corongiu, G., Clementi, E., (1993) METECC, Methods and Techniques in Computational Chemistry, , E. Clementi. Cagliari: Stef Chapter 12 
504 |a Kohn, W., Sham, L., (1965) J. Phys. Rev., A140, p. 1133 
504 |a Becke, A.D., (1988) J. Chem. Phys., 88, p. 1053 
504 |a Sim, F., Salahub, D.R., Chin, S., Dupuis, M., (1991) J. Chem. Phys., 95, p. 4317 
504 |a Sim, F., St-Amant, A., Papai, Y., Salahub, D.R., (1992) J. Am. Chem. Soc., 114, p. 4391 
504 |a Godbout, N., Salahub, D.R., Andzelm, J., Wimmer, E., (1992) Can. J. Chem., 70, p. 560 
504 |a Vosko, S.H., Wilk, L., Nusair, M., (1980) Can. J. Chem., 58, p. 1200 
504 |a Bray, M.R., Deeth, R.J., Paget, V.J., Sheen, P.D., (1996) Int. J. Quantum Chem., 61, p. 85 
504 |a Sosa, C., Andzelm, J., Elkin, B.C., Wimmer, E., (1992) J. Phys. Chem., 96, p. 6630 
504 |a Becke, A.D., (1993) J. Chem. Phys., 98, p. 5648 
504 |a Lee, C., Yang, W., Parr, R.G., (1988) Phys. Rev. B, 37, p. 785 
504 |a Cossi, M., Barone, V., Cammi, R., Tomasi, (1996) J. Chem. Phys. Lett., 255, p. 327 
504 |a Frisch, M.J., Trucks, G.W., Schlegel, H.B., Scuseria, G.E., Robb, M.A., Cheeseman, J.R., Zakrzewski, V.G., Pople, J.A., (1998) Gaussian 98, Rev. A7, , Gaussian, Inc.: Pittsburgh, PA 
504 |a Godwin, J.B., Meyer, T.J., (1971) Inorg. Chem., 10, p. 471 
504 |a The 13C NMR signal corresponding to the CF3 unit was not observed due to the C-F splitting 
520 3 |a The reaction of [Ru(bpy)2(NO)Cl]2+ with 2,2,2-trifluoroethylamine produced [Ru(bpy)2(NO)Cl]+ by electron transfer and a number of organic compounds formed via nucleophilic substitution of the intermediate 2,2,2-trifluoroethyldiazonium ion (free or coordinated). Density functional theory computed results suggest that stabilization of the trifluoroethyldiazonium ion by complexation is much larger than the one corresponding to the butyl ion, in agreement with the fact that no rearrangement products derived from CF3CH2+ were observed. © 2002 Elsevier Science Ltd. All rights reserved.  |l eng 
536 |a Detalles de la financiación: Universidad de Buenos Aires, TX-042 
536 |a Detalles de la financiación: Agencia Nacional de Promoción Científica y Tecnológica, 06-00000-01704 
536 |a Detalles de la financiación: This work was supported by University of Buenos Aires (project TX-042), VW Stiftung and ANPCYT (project # 06-00000-01704). We thank the Cambridge Crystallographic Data Center for having provided us the Cambridge Structural Database Version 5.18. F. D. and D. A. E. are members of the scientific staff of CONICET. F. D. S. and A. C. are UBA fellows. 
593 |a Departamento de Quı́mica Inorgánica, Analı́tica y Quı́mica Fı́sica/INQUIMAE, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, CEHA Buenos Aires, Ciudad Universitaria, Pabellón II, piso 3 (1428), Argentina 
690 1 0 |a 2,2,2-TRIFLUOROETHYLAMINE 
690 1 0 |a COMPLEX 
690 1 0 |a DENSITY FUNCTIONAL THEORY 
690 1 0 |a ELECTRON TRANSFER 
690 1 0 |a N-BUTYLAMINE 
690 1 0 |a NITROSYL 
690 1 0 |a RUTHENIUM 
690 1 0 |a 2,2,2 TRIFLUOROETHYLAMINE 
690 1 0 |a BUTYLAMINE 
690 1 0 |a ETHYLAMINE 
690 1 0 |a RUTHENIUM COMPLEX 
690 1 0 |a UNCLASSIFIED DRUG 
690 1 0 |a ARTICLE 
690 1 0 |a CALCULATION 
690 1 0 |a CHEMICAL REACTION 
690 1 0 |a COMPLEX FORMATION 
690 1 0 |a ELECTRON TRANSPORT 
690 1 0 |a MOLECULAR STABILITY 
690 1 0 |a PRIORITY JOURNAL 
690 1 0 |a REACTION ANALYSIS 
690 1 0 |a SOLVATION 
690 1 0 |a THEORY 
700 1 |a Crespo, A. 
700 1 |a Estrin, D.A. 
700 1 |a Doctorovich, F. 
773 0 |d 2002  |g v. 58  |h pp. 4237-4244  |k n. 21  |p Tetrahedron  |x 00404020  |w (AR-BaUEN)CENRE-45  |t Tetrahedron 
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