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FT-IR, RAMAN, AND NMR SPECTROSCOPY AND DFT THEORY OF GLIMEPIRIDE MOLECULE AS A SULFONYLUREA COMPOUND

Abstract

The glimepiride molecule was experimentally characterized using vibrational (FT-IR and laser-Raman) and NMR chemical shift spectroscopy. The molecule optimized structure, vibrational wavenumbers, and1H and13C NMR isotropic chemical shifts were theoretically obtained with the DFT/B3LYP method at a 6-311++G(d,p) basis set. The theoretical geometric parameters, vibrational wavenumbers, and NMR cheical shifts were found to be consistent with experimental data and similar spectral results in the literature.

About the Authors

T. . Özdemir
Bartın University, Vocational School of Health Services
Russian Federation


H. . Gökce
Giresun University, Vocational School of Health Services
Russian Federation


References

1. Türkiye Endokrinoloji ve Metabolizma Derneği. Diabetes Mellitus ve Komplikasyonlarının Tanı, Tedavive İzlem Kılavuzu, BAYT Bilimsel Araştırmalar Basın Yayınve Tanıtım Ltd. Şti, Miki Matbaacılık San. ve Tic. Ltd. Şti (2014).

2. American Diabetes Association. Diabetes Care, 33, 62 (2010).

3. Expert Committee on the Diagnosis and Classification of Diabetes Mellitus Diabetes Care, 20, 1183 (1997).

4. P. R. Njolstad, J. V. Sagen, L. Bjorkhaug, S. Odili, N. Shehadeh, D. Bakry, U. Sarici, F. Alpay, J. Molnes, A. Molven, O. Sovik, F. M. Matschinsky, Diabetes, 52, 11, 2854 (2003).

5. P. Odetti, S. Garibaldi, G. Noberasco, I. Aragno, S. Valentini, N. Traverso, U. M. Marinari, Acta Diabetol., 36, 4, 179 (1999).

6. U. Çakatay, Diabetes and Metabolism, 31, 6, 551 (2005).

7. T. Hamaguchi, T. Hirose, H. Asakawa, Y. Itoh, K. Kamado, K. Tokunaga, K. Tomita, H. Masuda, N. Watanabe, M. Namba, Diabetes Res. Clin. Pract., 66, 129 (2004).

8. A. Brayfield, Martindale: The Complete Drug Reference, 35 ed., CD ROM, The Pharmaceutical Press, London (2007).

9. http://www.sanofi-aventis, ca/products/en/amaryl.pdf (accessed 10.09.09).

10. S. N. Davis, J. Diabetes Complicat., 18, No. 6, 367 (2004).

11. T. G. Skillman, J. M. Feldman, Am. J. Med., 70, 361 (1981).

12. H. E. Lebovitz, M. N. Feinglos, Diabetes Care, 1, 189 (1978).

13. G. Arumugam, P. Manjula, N. Paari, J. Acute Disease, 3, No. 2, 196 (2013).

14. M. Remko, J. Mol. Struct. Theochem., 897, 73 (2009).

15. M. Karakaya, M. Kurekci, B. Eskiyurt, Y. Sert, C. Cırak, Spectrochim. Acta, A, 135, 137 (2015).

16. M. Iwata, H. Nagase, T. Endo, H. Ueda, Acta Crystallogr., C53, 329 (1997).

17. L. A. D. Maria Lestari, G. Indrayanto, Profiles of Drug Substances, Excipients, and Related Methodology, 36, 1871 (2011).

18. M. J. O’Neil, The Merck Index, Merck & Co., Inc., New Jersey (2001).

19. M. Karakaya, Y. Sert, M. Kürekçi, B.Eskiyurt, Ç. Çırak, J. Mol. Struct., 87, 1095 (2015).

20. R. Anitha, M. Gunasekaran, S. Suresh Kumar, S. Athimoolam, B. Sridhar, Spectrochim. Acta, A, 150, 488 (2015).

21. Y. Sert, B. Miroslaw, Ç. Çırak, H. Doğan, D. Szulczyk, M. Struga, Spectrochim. Acta A, 128, 91 (2014).

22. F. A. M. Al-Omary, M. Karakaya, Y. Sert, N. G.Haress, A. A. El-Emam, Ç. Çırak, J. Mol. Struct., 1076, 664 (2014).

23. E. Taşal, M. Kumalar, Spectrochim. Acta A, 95, 282 (2012).

24. R. Brause, H. Fricke, M. Gerhards, R. Weinkauf, K. Kleinermanns, Chem. Phys., 43, 327 (2006).

25. S. Murugavel, C. S. Jacob, P. Stephen, R. Subashini, H. R. Reddy, D. Krishnan, J. Mol. Struct., 134, 1122 (2016).

26. A. Barakat, S. M. Soliman. A. M. Al-Majid, G. Lotfy, H. A. Ghabbour, H. K. Fun, S. Yousuf, M. I. Choudhary, A. Wadood, J. Mol. Struct., 365, 1098 (2015).

27. H. Gökçe, N. Öztürk, Ü. Ceylan, Y. Alpaslan, B. Alpaslan, Spectrochim. Acta, A, 163, 170 (2016).

28. A. D. Becke, J. Chem. Phys., 98, 5648 (1993).

29. C. Lee, W. Yang, R. G. Parr, Phys. Rev. B, 37, 785 (1988).

30. A. Frish, A. B. Nielsen, A. J. Holder, Gauss View User Manual, Gaussian Inc., Pittsburg, PA (2001). 517-12

31. Gaussian 09, Revision, A.1, Gaussian Inc., Wallingford CT (2009).

32. http://www.gaussian.com/g_prod/gv5.htm (accessed 10.08.2016).

33. Y. B. S. Rao, M. V. S. Prasad, N. U. Sri, V. Veeraiah, J. Mol. Struct., 567, 1108 (2016).

34. G. Keresztury, S. Holly, J. Varga, G. Besenyei, A. Y. Wang, J. R. Durig, Spectrochim. Acta, A, 49, 2007(1993).

35. G. Keresztury, In: Raman Spectroscopy: Theory in Handbook of Vibrational Spectroscopy, Eds. J. M. Chalmers, P. R. Griffith, John Wiley&Sons Ltd., New York (2002).

36. J. Chocholousova, V. V. Spirko, P. Hobza, Chem. Phys., 6, 37 (2004).

37. N. Sundaaraganesan, S. Ilakiamani, H. Saleem, P. M. Wojciechowski, D. Michalska, Spectrochim. Acta, A, 61, 2995 (2005).

38. N. B. Colthup, L. H. Daly, E. Wiberley, Introduction to Infrared and Raman Spectroscopy, Academic Press, New York (1964).

39. L. J. Bellamy, The Infrared Spectra of Complex Molecules, 3rd ed., Willey, New York (1975).

40. R. M. Silverstein, F. X. Webster, Spectroscopic Identification of Organic Compound, Willey, New York (1998).

41. J. B. Lambert, H. F. Shurvell, R. G. Cooks, Introduction to Organic Spectroscopy, Macmillan, New York (1987).

42. B. H. Stuart, Infrared Spectroscopy: Fundamentals and Applications, Willey, New York (2004).

43. M. Barthes, G. De Nunzio, G. Riber, Synth. Methods, 76, 337 (1996).

44. S. Gunasekaran, P. Arunbalaji, S. Seshadri, S. Muthu, Indian J. Pure Appl. Phys., 46, 162 (2008).

45. G. Varsanyi, S. Szoke, Vibrational Spectra of Benzene Derivatives, Academic Press, New York (1969).

46. N. P. G. Roeges, A Guide to the Complete Interpretation of Infrared Spectra of Organic Structures, Willey, New York (1994).

47. K. R. Ambujakshan, V. S. Madhavan, H. T.Varghese, C. Y. Panicker, O. Temizarpaci, B. Tekiner-Gulbas, I. Yildiz, Spectrochim. Acta, A, 69, 782 (2008).

48. G. Varsanyi, Assignments for Vibrational Spectra of Seven Hundred Benzene Derivatives, Vol. I, II, Academic Kiado, Budapest (1973).

49. B. Smith, Infrared Spectral Interpretation - A Systematic Way, CRC Press, New York (1999).

50. J. Swaminathan, M. Ramalingam, V. Sethuraman, N. Sundaraganesan, S. Sebastain, Spectrochim. Acta A, 73, 593 (2009).

51. G. Socrates, Infrared Characteristic Group Frequencies, Willey, New York (1981).

52. M. S. Alam, D.-U. Lee, J. Mol. Struct., 174, 1128 (2017).


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For citations:


Özdemir T., Gökce H. FT-IR, RAMAN, AND NMR SPECTROSCOPY AND DFT THEORY OF GLIMEPIRIDE MOLECULE AS A SULFONYLUREA COMPOUND. Zhurnal Prikladnoii Spektroskopii. 2018;85(3):517(1)-517(12). (In Russ.)

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