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Vol. 33 No. 1 (2021): Vol 33 Issue 1

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Mechanical, Thermal Properties and Hirshfeld Surface Analysis of N-Acetylglycine Single Crystal

https://doi.org/10.14233/ajchem.2021.22983
V.J. Thanigaiarasu
Department of Physics, Jaya College of Arts and Science, Thiruninravur-602024, India
N. Kanagathara
Department of Physics, Saveetha School of Engineering, Saveetha Institute of Medical and Technical Sciences, Thandalam-602105, India
R. Usha
Department of Physics, Saveetha School of Engineering, Saveetha Institute of Medical and Technical Sciences, Thandalam-602105, India
V. Sabari
Department of Physics, Marudhar Kesari Jain College for Women, Vaniyambadi-635751, India
V. Natarajan
Department of Physics, Rajalakshmi Institute of Technology, Kuthambakkam-602124, India

Corresponding Author(s) : N. Kanagathara

kanagathara23275@gmail.com

Asian Journal of Chemistry, Vol. 33 No. 1 (2021): Vol 33 Issue 1

Abstract

Mechanical properties of some amino acid based derivatives plays a versatile role in the device fabrication due to its mechanical strength. One such acetyl derivative of glycine named N-acetylglycine has been taken in the present study for investigation. Hardness analysis has been carried out on the grown crystal with various loads and it was observed that Vicker’s hardness number (Hv) varied for different loads. The work hardening coefficient is calculated to be 1.628 which confirms that the grown crystal comes under moderately hard material category. Other mechanical parameters like minimum load indentation (W), materials constant (k1), load dependent constant (A1) and elastic stiffness constant (C11) have also been calculated. The thermal analysis has also been carried and it reveals that the complete weight loss of N-acetylglycine starts from 208.60 ºC and ends at 281.58 ºC. The corresponding DTA peak is observed at 217.97 ºC which is the melting point of the sample. As expected, there is no phase transition till the material melts and this enhances the temperature range for the utility of the crystal. Kinetic and thermodynamic parameters have been calculated. All the results obtained from hardness as well as thermal measurement confirm the material may be suitable for electro-optic device applications. Further, the 3D Hirshfeld surface analysis and 2D fingerprint maps gives deep insight into the intermolecular interactions between the compound.

Keywords

N-Acetylglycine Elastic stiffness constant Hirshfeld Meyer’s index Vicker’s Hardness number
Thanigaiarasu, V., Kanagathara, N., Usha, R., Sabari, V., & Natarajan, V. (2020). Mechanical, Thermal Properties and Hirshfeld Surface Analysis of N-Acetylglycine Single Crystal. Asian Journal of Chemistry, 33(1), 203–209. https://doi.org/10.14233/ajchem.2021.22983
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References
  1. M. Egart, B. Jankovic and S. Srèiè, Acta Pharm., 66, 303 (2016); https://doi.org/10.1515/acph-2016-0032
  2. R.W. Armstrong and W.L. Elban, Mater. Sci. Technol., 28, 1060 (2012); https://doi.org/10.1179/1743284712Y.0000000012
  3. J. Donohue and R.E. Marsh, Acta Crystallogr., 15, 941 (1962); https://doi.org/10.1107/S0365110X62002492
  4. H. Etori, K. Taga, H. Okabayashi and K. Ohshima, J. Chem. Soc., Faraday Trans., 93, 313 (1997); https://doi.org/10.1039/a605741a
  5. S. Bee, N. Choudhary, A. Gupta and P. Tandon, Biopolymers, 101, 795 (2014); https://doi.org/10.1002/bip.22458
  6. B. Boeckx and G. Maes, J. Phys. Chem. A, 116, 1956 (2012); https://doi.org/10.1021/jp211382u
  7. C. Bruyneel, A.K. Chandra, T. Uchimaru and T. Zeegers-Huyskens, Spectrochim. Acta A Mol. Biomol. Spectrosc., 56, 591 (2000); https://doi.org/10.1016/S1386-1425(99)00258-9
  8. R.E. Vizhi, R.A. Kumar, D.R. Babu, K. Sathiyanarayanan and G. Bhagavannarayana, Ferroelectrics, 413, 291 (2011); https://doi.org/10.1080/00150193.2011.531194)
  9. J. Baran and A.M. Petrosyan, Ferroelectrics, 432, 117 (2012); https://doi.org/10.1080/00150193.2012.707879
  10. H. Kumar, M. Singla and H. Mittal, J. Chem.Thermodyn.,94, 204 (2016);https://doi.org/10.1016/j.jct.2015.10.017
  11. D. Nagaraju, P.V. Raja Shekar, C.S. Chandra, K.K. Rao and N.G.Krishna, AIP Conf. Proc., 1591, 1259 (2014);https://doi.org/10.1063/1.4872923
  12. T. Balakrishnan and K. Ramamurthi, Mater. Lett., 62, 65 (2008); https://doi.org/10.1016/j.matlet.2007.04.072
  13. Y. Zhang, L. Feng and W. Qiu, J. Mater. Sci., 54, 9507 (2019); https://doi.org/10.1007/s10853-019-03543-3
  14. N. Nithya, R. Mahalakshmi and S. Sagadevan, Mater. Res., 18, 581 (2015); https://doi.org/10.1590/1516-1439.007015
  15. S. Suresh, A. Ramanand, P. Mani and K. Murthyanand, J. Optoelectron Biomed. Mater., 1, 129 (2010).
  16. S. Sagadevan, Int. J. Chem. Tech. Res., 6, 2645 (2014).
  17. A.A. Latha, M. Anbuchezhiyan, C.C. Kanakam and K. Selvarani, Mater.Sci. Pol., 35, 140 (2017);https://doi.org/10.1515/msp-2017-0031
  18. S. Vyazovkin, A.K. Burnham, J.M. Criado, L.A. Pérez-Maqueda, C.Popescu and N. Sbirrazzuoli, Thermochim. Acta, 520, 1 (2011);https://doi.org/10.1016/j.tca.2011.03.034
  19. S. Vyazovkin and I. Dranca, Macromol. Chem. Phys., 207, 20 (2006); https://doi.org/10.1002/macp.200500419
  20. V.L. Stanford, C.M. McCulley and S. Vyazovkin, J. Phys. Chem. B,120, 5703 (2016);https://doi.org/10.1021/acs.jpcb.6b03860
  21. X.G. Li, M.R. Huang, G.-H. Guan and T. Sun, Polym. Int., 46, 289(1998);https://doi.org/10.1002/(SICI)1097-0126(199808)46:4<289::AIDPI993>3.0.CO;2-O
  22. X.G. Li, J. Appl. Polym. Sci., 74, 2016 (1999);https://doi.org/10.1002/(SICI)1097-4628(19991121)74:8<2016::AIDAPP17>3.0.CO;2-T
  23. N. Kanagathara, M.K. Marchewka, S. Gunasekaran and G. Anbalagan, Acta Phys. Pol. A, 126, 827 (2014);https://doi.org/10.12693/APhysPolA.126.827
  24. R. Bhuvaneswari, G. Vinitha and K. Sakthi Murugesan, Appl. Phys., AMater. Sci. Process., 125, 385 (2019);https://doi.org/10.1007/s00339-019-2678-6
  25. A. Bhaskaran, C.M. Ragavan, R. Sankar, R. Mohan Kumar and R.Jayavel, Cryst. Res. Technol., 42, 477 (2007);https://doi.org/10.1002/crat.200610851
  26. K. Sangwal, Cryst. Res. Technol., 44, 1019 (2009); https://doi.org/10.1002/crat.200900385
  27. M. Shkir, S. Muhammad, S. AlFaify, A. Irfan, M.A. Khan, A.G. Al-Sehemi, I.S. Yahia, B. Singh and I. Bdikin, J. Saudi Chem. Soc., 22, 352 (2018); https://doi.org/10.1016/j.jscs.2016.05.003
  28. K. Boopathi, P. Rajesh, P. Ramasamy, Prapun Manyum, Opt. Mater.,35, 954 (2013);https://doi.org/10.1016/j.optmat.2012.11.015
  29. T.B. Krishnan, P. Revathi, S. Sakthivel and K. Ramamurthi, J. Taibah Univ. Sci., 12, 208 (2018); https://doi.org/10.1080/16583655.2018.1451106
  30. H. Kamari, N. Al-Hada, E. Saion, A. Shaari, Z. Talib, M. Flaifel and A.Ahmed, Crystals, 7, 2 (2017); https://doi.org/10.3390/cryst7020002
  31. K. Selvakumar, Indian J. Sci. Technol., 9, 1 (2016); https://doi.org/10.17485/ijst/2016/v9i36/101967
  32. K. Harada, Nature, 214, 479 (1967); https://doi.org/10.1038/214479a0
  33. V.Y. Yablokov, I.L. Smel’tsova, I.A. Zelyaev and S.V. Mitrofanova, Russ. J. Gen. Chem., 79, 1704 (2009); https://doi.org/10.1134/S1070363209080209
  34. A. Schaberg, R. Wroblowski and R. Goertz, J. Phys. Conf. Ser., 1107,032013 (2018); https://doi.org/10.1088/1742-6596/1107/3/032013
  35. N. Kanagathara, M.K. Marchewka, N. Sivakumar, N.G. Renganathan, K. Gayathri, S. Gunasekaran and G. Anbalagan, J. Therm. Anal. Calorim.,112, 1317 (2013); https://doi.org/10.1007/s10973-012-2713-8
  36. K.J. Laidler, Chemical Kinetics, Harper & Row: New York (1987).
  37. K.D. Parikh, D.J. Dave, B.B. Parekh, M.J. Joshi and Thermal, Bull. Mater. Sci., 30, 105 (2007); https://doi.org/10.1007/s12034-007-0019-4
  38. A. Broido, J. Polym. Sci. Part A-2, 7, 1761 (1969); https://doi.org/10.1002/pol.1969.160071012
  39. H.H. Horowitz and G. Metzger, Anal. Chem., 35, 1464 (1963); https://doi.org/10.1021/ac60203a013
  40. A.W. Coats and J.P. Redfern, Nature, 201, 68 (1964); https://doi.org/10.1038/201068a0
  41. S.L. Price, J. Chem. Soc. Faraday Trans., 92, 2997 (1996); https://doi.org/10.1039/FT9969202997
  42. S.L. Price, eds.: Ed.: A. Gavezzotti, Theoretical Aspects and Computer Modeling of the Molecular Solid State, Wiley: Chichester, pp. 31-60(1997).
  43. K.R. Seddon, eds.: K.R. Seddon and M. Zaworotko, Crystal Engineering, In: The Design and Application of Functional Solids, Kluwer Academic: Amsterdam, pp. 1-28 (1999).
  44. F.H. Allen, Acta Crystallogr. B, 58, 380 (2002);https://doi.org/10.1107/S0108768102003890
  45. G.R. Desiraju, Chem. Commun., 1475 (1997);https://doi.org/10.1039/a607149j
  46. F.L. Hirshfeld, Theor. Chim. Acta, 44, 129 (1977);https://doi.org/10.1007/BF00549096
  47. M.J. Turner, J.J. McKinnon, S.K. Wolff, D.J. Grimwood, P.R. Spackman,D. Jayatilaka and M.A. Spackman, CrystalExplorer17 (2017).
  48. M.A. Spackman, J.J. McKinnon and D. Jayatilaka, CrystEngComm,10, 377 (2008).
  49. M.A. Spackman and J.J. McKinnon, CrystEngComm, 4, 378 (2002); https://doi.org/10.1039/B203191B
  50. S.K. Wolff, D.J. Greenwood, J.J. McKinnon, M.J. Turner, D. Jayatilaka and M.A. Spackman, Crystal Explorer, Version 3.1 (2012).
  51. M.A. Spackman and J.J. McKinnon, CrystEngComm, 4, 378 (2002); https://doi.org/10.1039/B203191B
  52. M.A. Spackman and D. Jayatilaka, CrystEngComm, 11, 19 (2009);https://doi.org/10.1039/B818330A
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