Optical properties of Meloxicam in the far-infrared spectral region

Yusuf Samet Aytekin, Mustafa Köktürk, Adam Zaczek, Timothy M. Korter, Edwin J. Heilweil, Okan Esenturk

Research output: Contribution to journalArticlepeer-review

4 Scopus citations

Abstract

One of the most commonly used nonsteroidal anti-inflammatory active pharmaceutical ingredient called Meloxicam has been characterized spectroscopically both by Terahertz (THz) time domain spectroscopy (THz-TDS) and by Fourier Transform Infrared (FTIR) spectroscopy in far-IR regions of electromagnetic spectrum; 0.2 THz–20 THz. While many relatively sharp features are observed in the far-IR range between 2 THz–20 THz as expected for being an organic substance, very distinct and relatively strong absorption bands are also observed at 1.00, 1.66, 2.07 and 2.57 THz in the THz range. These well separated, defined, and fairly strong spectral features can be used for discrimination and quantification of Meloxicam in drug analysis. Frequency dependent refractive index of the drug was determined in a range of 0.2 THz–2.7 THz, where an almost constant index was observed with an average index of 1.75. Powder XRD, and solid-state Density Functional Theory (SS-DFT) calculations were utilized to determine the crystalline form of the Meloxicam sample in its enolic crystalline form. Single molecule DFT calculations were also performed in all four possible structures of Meloxicam. In addition, the capability of THz waves transmission through common packaging materials is demonstrated for possibility of future on-site analysis. The results suggest that drug analysis will be possible to perform not only at every stage of manufacturing without destruction but also directly at the shelf of a market after development of portable THz technologies.

Original languageEnglish (US)
Pages (from-to)36-43
Number of pages8
JournalChemical Physics
Volume512
DOIs
StatePublished - Aug 17 2018

Keywords

  • API characterization
  • Active pharmaceutical ingredients (API)
  • Infrared spectroscopy
  • THz-TDS

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

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