The glimepiride molecule was experimentally characterized using vibrational (FT-IR and laser-Raman) and NMR chemical shift spectroscopy. The molecule optimized structure, vibrational wavenumbers, and 1H and 13C NMR isotropic chemical shifts were theoretically obtained with the DFT/B3LYP method at a 6-311++G(d,p) basis set. The theoretical geometric parameters, vibrational wavenumbers, and NMR che mical shifts were found to be consistent with experimental data and similar spectral results in the literature.
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20 September 2018
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Abstract of article is published in Zhurnal Prikladnoi Spektroskopii, Vol. 85, No. 3, p. 517, May–June, 2018.
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Özdemi, T., Gökce, H. FT-IR, Raman, and NMR Spectroscopy and DFT Theory of Glimepiride Molecule as a Sulfonylurea Compound. J Appl Spectrosc 85, 560–572 (2018). https://doi.org/10.1007/s10812-018-0687-4
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DOI: https://doi.org/10.1007/s10812-018-0687-4