Computational note on vibrational spectra of Tyramine hydrochloride: DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 847, Issue 1-3, 2007, Pages 101-102

  Siddiqui, Shamoon Ahmad ^a   Dwivedi, Apoorva ^a   Misra, Neeraj ^a   Sundaraganesan, N ^b  

^a UNIVERSITY OF LUCKNOW   (India)

^b ANNAMALAI UNIVERSITY   (India)

Author keywords

Ab initio and DFT; FT IR and FT Raman spectra; Tyramine hydrochloride; Vibrational analysis

Indexed keywords

EID: 36049031205     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2007.09.003     Document Type: Article

References (3)

1. Aloka Podder J.K., Saha Dattagupta N.N., and Saenger W. Crystal and molecular structure of a sympathomimetic amine, Tyramine hydrochloride. Acta Cryst. B35 (1979) 649
2. M.J. Frisch et al., Gaussian 03, Gaussian Inc., Wallingford, CT, 2004.
3. Pople J.A., Schlegel H.B., Krishnan R., Defrees D.J., Binkley J.S., Frish M.J., Whiteside R.A., Hout R.H., and Hehre W.J. Molecular orbital studies of vibrational frequencies. Int. J. Quant. Chem. Symp. 15 (1981) 269