- Spectroscopy and Spectral Analysis
- Vol. 41, Issue 9, 2859 (2021)
Fig. 1. The molecular structure of ABA
Fig. 2. Molecular orbital energy level diagram of ABA
Fig. 3. Distribution of molecular orbital electron clouds of ABA
Fig. 4. The comparison of DFT calculation, Raman and SERS experiment of ABA
Fig. 5. Infrared absorption spectra of ABA(IR)
(a): Experiment-IR spectrum; (b): DFT-IR spectrum
(a): Experiment-IR spectrum; (b): DFT-IR spectrum
Fig. 6. 1H-NMR of the ABA
Fig. 7. 13C-NMR of the ABA
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Table 1. DFT, Raman and SERS characteristic peaks of ABA and their attribution
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Table 2. 1H-NMR relative displacement of ABA
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Table 3. 13C-NMR relative displacement of ABA
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