Vibrational spectra and relative stability of the van der Waals complexes formed between 1,2-butadiene and HCl: A FTIR and density functional study

Journal of Molecular Structure

Volumn 480-481, Issue , 1999, Pages 495-498

  Herrebout, W A ^a   Van Den Kerkhof, T ^a   Van Der Veken, B J ^a  

^a UNIVERSITY OF ANTWERP   (Belgium)

Author keywords

Ab initio calculations; Cryosolutions; HCl; Infrared spectroscopy; Van der Waals molecules

Indexed keywords

1,2 BUTADIENE; 1,3 BUTADIENE; CHLORIDE; UNCLASSIFIED DRUG;

COMPLEX FORMATION; CONFERENCE PAPER; DISSOLUTION; ENERGY TRANSFER; FOURIER TRANSFORMATION; MOLECULAR INTERACTION; VIBRATION;

EID: 0033522588     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(98)00776-5     Document Type: Conference Paper

References (4)

1. W.A. Herrebout, G.P. Everaert, B.J. van der Veken, unpublished results.
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3. Gaussian 94, Revision B2, M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, J. Cioslowski, B.B. Stefanov, A. Nanayakkara, M. Challacombe, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzalez, J.A. Pople, Gaussian, Inc., Pittsburgh PA, 1995.
4. W.A. Herrebout, B.J. van der Veken, J. Mol. Struct., 449 (1998) 231.