Vibrational Frequencies, Structural Confirmation Stability and Homo-lumo Analysis of Nicotinic Acid Ethyl Ester with Experimental (ft-ir and Ft-raman) Techniques and Quantum Mechanical Calculations
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چکیده
The use of nicotinic acid derivatives in the field of medicinal, biomedical industries, production of cosmetics, pesticides, agro chemical industries and its biological activities have been studied extensively over the past decades. In this chapter, one of such nicotinic acid derivative called Nicotinic Acid Ethyl Ester (also known ethyl nicotinate, Ethyl 3-pyridinecarboxylate and 3-pyridinecarboxylic acid, ethyl ester) have been choosen for the study so as to interpret its vibrational frequencies, structural conformational stabilities, thermal properties, HOMO-LUMO analysis using FTIR and FT-Raman Spectra. In this title molecule, the H atom in the nicotinic acid was replaced by CH2-CH3 group
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