Quantum-chemical study of the adducts of silicon halides with nitrogen-containing donors: II. Calculation of a donor-acceptor bond energy. Complex trans-SiH4·2NH3

Russian Journal of General Chemistry

Volumn 72, Issue 12, 2002, Pages 1911-1915

  Timoshkin, A Yu ^a   Sevast'yanova, T N ^a   Davydova, E I ^a   Suvorov, A V ^a   Schaefer III, H F ^a  

^a ST PETERSBURG STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

AMMONIUM DERIVATIVE; HALIDE; SILICON DERIVATIVE;

ANALYTICAL ERROR; ARTICLE; CALCULATION; CHEMICAL BOND; CHEMICAL STRUCTURE; COMPLEX FORMATION; DISSOCIATION; ENERGY TRANSFER; QUANTUM CHEMISTRY; REACTION ANALYSIS; THERMODYNAMICS; TRANS ISOMER;

EID: 0038366401     PISSN: 10703632     EISSN: None     Source Type: Journal    
DOI: 10.1023/A:1023407127585     Document Type: Article

References (13)

1. Timoshkin, A.Yu., Sevast'yanova, T.N., Davydova, E.I., and Suvorov, A.V., Zh. Obshch. Khim., 2002, vol. 72, no. 10, pp. 1674-1684.
2. Gur'yanova, E.N., Gol'dshtein, I.P., and Romm, I.P., Donorno-aktseptornaya svyaz' (Donor-Acceptor Bond), Moscow: Khimiya, 1973.
3. Timoshkin, A.Yu., Suvorov, A.V., and Schaefer, H.F., Zh. Neorg. Khim., 2000, vol. 45, no. 3, pp. 509-512.
4. timoshkin, A.Y., Suvorov, A.V., Bettinger, H.F., and Schaefer, H.F. III, J. Am. Chem. Soc., 1999, vol. 121, no. 24, pp. 5687-5699.
5. Frisch, M.J., Trucks, G.W., Schlegel, H.B., Gill, P.M.W., Johnson, B.G., Robb, M.A., Cheeseman, J.R., Keith, T., Petersson, G.A., Montgomery, J.A., Raghavachari, K., Al-Laham, M.A., Zakrzewski, V.G., Ortiz, J.V., Forestman, J.B., Cioslowski, J., Stefanov, B.B., Nanayakkara, A., Challacombe, M., Peng, C.Y., Ayala, P.Y., Chen, W., Wong, M.W., Andres, J.L., Replogle, E.S., Gomperts, R., Martin, R.L., Fox, D.J., Binkley, J.S., Defrees, D.J., Barker, J., Stewart, J.P., Head-Gordon, M., Gonzalez, C., and Pople, J.A., GAUSSIAN 94, Rev. C.3, Pittsburgh: Gaussian, 1995.
6. Modern Theoretical Chemistry, Schaefer, H.F., Ed., New York: Plenum, 1976, vol. 3, p. 1.
7. Becke, A.D., J. Chem. Phys., 1993, vol. 98, no. 7, pp. 5648-5652.
8. Lee, C., Yang, W., and Parr, R.G., Phys. Rev. B, 1988, vol. 37, no. 2, pp. 785-793.
9. Timoshkin, A.Y., Bettinger, H.F., and Schaefer, H.F., J. Phys. Chem. A, 2001, vol. 105, no. 13, pp. 3240-3248.
10. Boys, S.F. and Bernardi, F., Mol. Phys., 1970, vol. 19, no. 10, pp. 553-566.
11. Jasien, P.G., J. Phys. Chem., 1994, vol. 98, no. 11, pp. 2859-2864.
12. Jungwirth, P. and Zahradnik, R., J. Mol. Struct. (Theochem), 1993, vol. 283, pp. 317-320.
13. Meininger, D.R. and Ault, B.S., J. Phys. Chem. A, 2000, vol. 104, no. 16, pp. 3481-3486.