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ISSN: 1023-5086

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ISSN: 1023-5086

Scientific and technical

Opticheskii Zhurnal

A full-text English translation of the journal is published by Optica Publishing Group under the title “Journal of Optical Technology”

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DOI: 10.17586/1023-5086-2020-87-07-73-79

УДК: 535.8, 617.7

Analysis of the terahertz characteristics of pesticide residue isomers

For Russian citation (Opticheskii Zhurnal):
Jianjun Liu. Анализ терагерцовых характеристик остаточных изомеров пестицидов // Оптический журнал. 2020. Т. 87. № 7. С. 7379. http://doi.org/10.17586/1023-5086-2020-87-07-73-79   Jianjun Liu. Analysis of the terahertz characteristics of pesticide residue isomers [in English] // Opticheskii Zhurnal. 2020. V. 87. № 7. P. 73–79. http://doi.org/10.17586/1023-5086-2020-87-07-73-79
For citation (Journal of Optical Technology):

Jianjun Liu, "Analysis of the terahertz characteristics of pesticide residue isomers," Journal of Optical Technology . 87(7), 440-444 (2020).  https://doi.org/10.1364/JOT.87.000440

Abstract:

The detection of pesticide isomers is a great advantage in the agricultural pharmaceutical industry. Terahertz spectroscopy can be used in such applications because it is very sensitive to intermolecular interactions. Although it is challenging to understand the basic properties of lattice vibrations that cause terahertz absorption, it can be achieved by calculation. In this paper, the terahertz spectra of dimethylamine and dimethylamine-p isomers of pesticide residues were determined by terahertz spectroscopy, and their terahertz absorption vibration properties were analyzed by quantum chemistry method. The results show that terahertz spectroscopy can realize the identification and quantitative analysis of isomers and verify the reliability and practicability of quantum chemistry in calculating low frequency vibration motion.

Keywords:

terahertz, detection, isomers, spectroscopy

OCIS codes: 300.0300, 040.2235, 010.1030

References:

1.    Byrn S., Pfeiffer R., Ganey M., Hoiberg C., Poochikian G. Pharmaceutical solids: A strategic approach to regulatory considerations // Pharm. Res. 1995. V. 12(7). P. 945–954.

2.   Singhal D., Curatolo W. Drug polymorphism and dosage form design: A practical perspective // Drug Delivery Rev. 2004. V. 56(3). P. 335–347.

3.   Stephen P.F., Miller A.S., Lawrence X.Yu. Scientific considerations of pharmaceutical solid polymorphism in regulatory applications // Advanced Sci. 2007. V. 38(13). P. 531–536.

4.   Xiaoxia Liang, Qiaojia Fan. Application of sub-critical water extraction in pharmaceutical industry // Scientific Res. 2013. V. 5(1). P. 1–6.

5.   Chakkittakandy R., Corver A.W.M., Planken P.C.M. Terahertz spectroscopy to identify the polymorphs in freeze-dried mannitol // J. Pharm. Sci. 2010. V. 99(2). P. 932–940.

6.   Walther M., Fischer B.M., and Jepsen P.U. Noncovalent intermolecular forces in polycrystalline and amorphous saccharides in the far infrared // Chem. Phys. 2003. V. 288(2–3). P. 261–268.

7.    Walther M., Fischer B.M., Ortner A., Bitzer A., Thoman A., and Helm H. Chemical sensing and imaging with pulsed terahertz radiation // Analytical and Bioanalytical Chem. 2010. V. 397. P. 1009–1017.

8.   Takahashi M. and Ishikawa Y. Terahertz vibrations of crystalline a-D-glucose and the spectral change in mutual transitions between the anhydride and monohydrate // Chem. Phys. Lett. 2015. V. 642. P. 29–34.

9.   Takahashi M. Terahertz vibrations and hydrogen-bonded networks in crystals // Crystals. 2014. V. 4. P. 74–103.

10. Oppenheim K.C., Korter T.M., Melinger J.S., and Grischkowsky D. Solid-state density functional theory investigation of the terahertz spectra of the structural isomers 1,2-dicyanobenzene and 1,3-dicyanobenzene // J. Phys. Chem. A. 2010. V. 114(47) P. 12513–12521.

11.  Dash J., Ray S., Nallappan K., Kaware V., Basutkar N., Gonnade R.G., Ambade A.V., Joshi K., and Pesala B. Terahertz spectroscopy and solid-state density functional theory calculations of cyanobenzaldehyde isomers // J. Phys. Chem. A. 2015. V. 119. P. 7991–7999.

12.  Oppenheim K.C., Korter T.M., Melinger J.S., and Grischkowsky D. Physical properties and inclusion interactions of new stilbazolium salts: Experimental versus theoretical study // J. Phys. Chem. A. 2010. V. 114. P. 12513–12521.

13.  Lu J., Zhai Y., and Sun F. Research of mitochondrial calcium transportation // Acta Biophysica Sinica. 2013. V. 29(3). P. 167–180.

14.  Sordahl L.A., Stewart M.L. Mechanism(s) of altered mitochondrial calcium transport in acutely ischemic canine hearts // Circulation Res. 1980. V. 47. P. 814–820.

15.  Rorie R.W., Delgado P.A., Lester T.D. Variation among beef bulls in the ratio of X- to Y-chromosome bearing spermatozoa // Scientific Res. 2014. V. 2(4). P. 69–75.

16.  Siegrist K., Bucher C.R., Mandelbaum I., Hight W.A.R., Balu R., Gregurick S.K., Plusquellic D.F.J. High-resolution terahertz spectroscopy of crystalline trialanine:  Extreme sensitivity to b-sheet structure and cocrystallized water // Chem. Soc. 2006. V. 128(17). P. 5764–5775.

17.  Allis D.G., Hakey P.M., Korter T.M. The solid-state terahertz spectrum of MDMA (Ecstasy) – A unique test for molecular modeling assignments // Chem. Phys. Lett. 2008. V. 463(4–6). P. 353–356.

18.       Hakey P.M., Allis D.G., Hudson M.R., Ouellette W., Korter T.M. Investigation of (1R, 2S)-(-)-ephedrine by cryogenic terahertz spectroscopy and solid-state density functional theory // Chem. Phys. Chem. 2009. V. 10. P. 2434–2444.