Vibrational Spectroscopic Features of Ibuprofen and Ketoprofen: IR and Raman Spectroscopy Combined with DFT Calculations

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发表日期：

2024年8月14日

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K. Logacheva,
P. Gergelezhiu,
E. Raksha,
L. Savostina,
G. Arzumanyan,
A. Eresko,
S. Malakhov,
K. Mamatkulov,
O. Ponomareva,
A. Belushkin,
D. Chudoba

摘要

Abstract

Vibrational spectroscopic features of ibuprofen and ketoprofen (non-steroidal anti-inflammatory drugs) were determined as a result of joint analysis of experimental and DFT-calculated data. There is a good agreement between the experimental (IR, Raman) and calculated (BP86/def2-SVP) vibrational frequencies of ibuprofen and ketoprofen.