Molecular Structure, NMR, HOMO, LUMO, and Vibrational Analysis of O-Anisic Acid and Anisic Acid Based on DFT Calculations

<div class="floats-full-page floats-full-page-figure"><h2>Figure 3</h2><div class="floats-full-page-caption"><table>FT-Raman spectra of O-Anisic acid (a) observed and (b) calculated with B3LYP/6-31G**.</table></div><div class="floats-full-page-content"><table class="table-group" width="800px"><tr class="fig-image" id="a"><td><img alt="171735.fig.003a" src="https://static-01.hindawi.com/articles/jspec/volume-2013/171735/figures/171735.fig.003a.jpg" /></td></tr><tr class="fig-caption"><td align="center"><table><tr><td><b>(a) </b></td></tr></table></td></tr><tr class="fig-image" id="b"><td><img alt="171735.fig.003b" src="https://static-01.hindawi.com/articles/jspec/volume-2013/171735/figures/171735.fig.003b.jpg" /></td></tr><tr class="fig-caption"><td align="center"><table><tr><td><b>(b) </b></td></tr></table></td></tr></table></div></div>

Figure 3 | Molecular Structure, NMR, HOMO, LUMO, and Vibrational Analysis of O-Anisic Acid and Anisic Acid Based on DFT Calculations

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Figure 3: Molecular Structure, NMR, HOMO, LUMO, and Vibrational Analysis of O-Anisic Acid and Anisic Acid Based on DFT Calculations

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Figure 3

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<p><em>Journal of Spectroscopy</em> publishes research into the theory and application of spectroscopy across all disciplines, including biology, chemistry, engineering, earth sciences, medicine, materials science, physics, and space science.</p>


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