Jmol による分子振動の表示 Presentation of Molecular Vibration by Using JSmol
フタル酸 (o-ベンゼンジカルボン酸) Phthalic acid (o-Benzenedicarboxylic acid) C8H6O4
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Theoretical Vibrational Spectrum Calculated by B3LYP/6-31G* Method