Vibrational spectroscopic studies (FTIR and FT-Raman) and molecular dynamics analysis of industry inspired 3-amino-4-hydroxybenzene sulfonic acid
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DOI: 10.1016/j.molstruc.2019.127579
Abstract: Abstract In the present study, structural properties of 3-amino-4-hydroxybenzene sulfonic acid (3A4HBSA) have been studied extensively utilizing Density Functional Theory (DFT) by employing three common functionals (B3LYP-D3BJ, M06–2X and APF-D). The FTIR and FT-Raman spectra… read more here.
Keywords: vibrational spectroscopic; amino hydroxybenzene; sulfonic acid; ftir raman ... See more keywords