DFT studies and vibrational spectra of trans 1,2-bis(4-pyridyl)ethylene and its zinc(II)halide complexes

2006-03-17
Ozhamam, Z
Yurdakul, Murat Hayrettin
Yurdakul, S
The geometry, frequency and intensity of the vibrational bands of trans 1,2-bis(4-pyridyl)ethylene (which is abbreviated as bpe) were obtained using the density functional theory (DFT) with the BLYP, B3LYP, B3PW91 functionals and 6-311G* basis set.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

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Citation Formats
Z. Ozhamam, M. H. Yurdakul, and S. Yurdakul, “DFT studies and vibrational spectra of trans 1,2-bis(4-pyridyl)ethylene and its zinc(II)halide complexes,” JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, pp. 113–118, 2006, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/32202.