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Computational study of IR, Raman, and NMR spectra of 4-methylmethcathinone drug

Valentina Minaeva1, Boris Minaev1, Alexander Panchenko2

  • 1Bohdan Khmelnytsky National University, Cherkasy, 18031, Ukraine.

Journal of Molecular Modeling
|January 2, 2021
PubMed

Keywords:
4-methylmethcathinone4-methylmethcathinone hydrochlorideB3LYPDFT calculationForce fieldIRMagnetic shielding tensorsRamanUV and NMR spectra

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