Faculty Publications

Pasha Ebrahimi, Ph.D.

Publications

Bade, T. S., Ebrahimi, H. P., Alsalim, T. A., et al.  (2017). A novel series of 1, 4-Dihydropyridine (DHP) derivatives bearing thiazolidin-4-one: From synthesis to structure. Journal of Molecular Structure, 1138, 136-148.

Ebrahimi, H. P., Hadi, J. S., et al. (2016). Metal-based biologically active azoles and β-lactam antibiotics derived from sulfa drugs. Bioorganic and Medicinal Chemistry, 24, 1121-1131.

Ebrahimi, H. P., and Shaghaghi, H., (2016). A simple graphical approach to predict local residue conformation using NMR chemical shifts and density functional theory. Journal of Computational Chemistry, 37, 1296-1305.

Ebrahimi, H. P., Hadi, J. S., et al, (2015). A new series of thiosemicarbazone drugs: From synthesis to structure. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 137, 1067-1077.

Ebrahimi, H. P., Hadi, J. S., Abdulnabi, Z. A., and Bolandnazar, Z. (2014). Spectroscopic, thermal analysis and DFT computational studies of Salen-type Schiff base complexes. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 117C, 485-492.

Ebrahimi, H. P., Hadi, J. S., and Al-Ansari, H. S. (2013). A new series of Schiff bases derived from sulfa drugs and indole-3-carboxaldehyde: synthesis, characterization, spectral and DFT computational studies. Journal of Molecular Structure, 1039, 37-45.

Ebrahimi, H. P., and Tafazzoli, M., (2013). Probing theoretical level effect on Fluorine chemical shielding calculations. Concepts in Magnetic Resonance, 42A, 140-153.

Shaghaghi, H., Ebrahimi, H. P., Bahrami Panah, N., and Tafazzoli, M., (2013). Layer selection effect on solid state 13C and 15N chemical shifts calculation using ONIOM approach. Solid State Nuclear Magnetic Resonance, 51, 31-36.

Shaghaghi, H., Ebrahimi, H. P., and Tafazzoli, M., (2013). Quantitative prediction of 13C NMR chemical shifts in solvent using PCM-ONIOM method and optimally selected wave function. Concepts in Magnetic Resonance, 42A, 1-13.

Ebrahimi, H. P., and M. Tafazzoli,M., (2012). An approach to evaluation of 19F NMR chemical shifts via basis functions analysis in fluorinated small compounds. Concepts in Magnetic Resonance, 40A, 192-204.