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  • Ge, Meilan  (2)
  • Wu, Bin  (2)
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  • 1
    In: Sensors, MDPI AG, Vol. 22, No. 11 ( 2022-05-27), p. 4053-
    Abstract: The pharmaceutical co-crystal has attracted increasing interest due to the improvement of physicochemical properties of active pharmaceutical ingredients. The characterization of pharmaceutical co-crystal is an integral part of the pharmaceutical field. In this paper, the low-frequency vibrational properties for carbamazepine co-crystals with nicotinamide and saccharin (CBZ-NIC and CBZ-SAC) have been characterized by combining the THz spectroscopy with low-wavenumber Raman spectroscopy. The experiment results show that, compared with the individual constituents, CBZ-NIC and CBZ-SAC co-crystals not only have different characteristic absorption peaks in the 0.3-2.5 THz region, but also have significant low-wavenumber Raman characteristic peaks in 0–100 cm−1. Density functional theory was performed to simulate the terahertz and low-wavenumber Raman spectra of the two co-crystals, where the calculation agreed well with the measured vibrational peak positions. The vibrational modes of CBZ-NIC and CBZ-SAC co-crystals were assigned through comparing theoretical results with the experimental spectra. Meanwhile, the low-frequency infrared and/or Raman active of characteristic peaks for such co-crystals were discussed. The results indicate the combination of THz spectroscopy and low-wavenumber Raman spectroscopy can provide more comprehensive low-frequency vibrational information for pharmaceutical co-crystals, such as collective vibration and skeleton vibration, which could play an important role in pharmaceutical science.
    Type of Medium: Online Resource
    ISSN: 1424-8220
    Language: English
    Publisher: MDPI AG
    Publication Date: 2022
    detail.hit.zdb_id: 2052857-7
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  • 2
    In: Photonics, MDPI AG, Vol. 9, No. 5 ( 2022-05-05), p. 313-
    Abstract: With the unique advantages of mineral TCMs gradually emerging in clinical treatment, health care, and precaution, it has played an important role in the international medical market. Commonly, mineral TCMs with similar appearance and different processing methods have different effects, but they are easy to be confused in preparation, storage, transportation, and other links, which affects the use and causes related problems. In this paper, six kinds of easily confused mineral TCMs, including coral skeleton, ophicalcitum, calamine, matrii sulfas exsiccatus, gypsum, and alumen, are rapidly characterized using Raman spectroscopy, which can be distinguished with different Raman peaks at 0–300 cm−1 due to the different lattice structure. The THz spectra of these mineral TCMs show that different mineral TCMs have different THz absorption coefficients at 0.3–2.0 THz. Furthermore, compared with the ineffectiveness of the Raman spectrum for differentiating mineral TCMs prepared with disparate processing methods, the terahertz absorption spectrum plays an active role in making up the limitation of low-wavenumber Raman spectroscopy. The combination of low-wavenumber Raman and THz spectroscopy provides a simple and feasible scheme for the identification of mineral TCMs, which could play an important role in the quality control of mineral TCMs.
    Type of Medium: Online Resource
    ISSN: 2304-6732
    Language: English
    Publisher: MDPI AG
    Publication Date: 2022
    detail.hit.zdb_id: 2770002-1
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