References
- T.Q. Toan, T.D. Phong, D.D. Tien, N.M. Linh and N.T. Mai Anh, Nat. Prod. Commun. 16 (2) (2021). doi:10.1177/1934578X21996184.
- K. Vamsi and P.K. Bholla, Int. J. Dent. Sci. Res. 2 (6C), 14–16 (2014). doi:10.12691/ijdsr-2-6C-4.
- S. Anbalagan, M. Sankareswaran, P. Rajendran and M. Karthikeyan, World J. Pharm. Pharmaceut. Sci. 4 (3), 1136–1144 (2015).
- T.R. Shantha, S. Pashupathy, J.K.P. Shetty, B. Vijayalakshmi, P. Kandavel and T. Bikshapathy, Ancient Sci. Life. XXI (1), 1–12 (2001).
- S.N. Yoganarasimhan, Medicinal Plants of India-Tamilnadu, Vol II (Cyber Media, Bangalore, 2000), p. 276.
- A. Dwivedi, A.K. Pandey and N. Misra, Spectrosc. Int. J. 26, 367 (2011). doi:10.1155/2011/979124.
- A.K. Pandey, S.A. Siddiqui, A. Dwivedi, K. Raj and N. Misra, Spectrosc. Int. J. 25, 287 (2011). doi:10.1155/2011/361849.
- A. El-Nasser, G. Mohamed and S.A. Abdel-Latif, Appl. Organomet. Chem. 37 (3), e6998 (2023). doi:10.1002/aoc.6998.
- N.S. Abdel-Kader, S.A. Abdel-Latif, A.L. El-Ansary and M.A. Hemeda, Polycyclic Aromat. Compd., 1–32 (2023). doi:10.1080/10406638.2023.2237629.
- A.H. Elwahy, M.E. Eid, S.A. Abdel-Latif, H.M. Hassaneen and I.A. Abdelhamid, Polycyclic Aromat. Compd. 43 (7), 6407–6436 (2023). doi:10.1080/10406638.2022.2117204.
- H.A. Al-Shamiri, M.E. Sakr, S.A. Abdel-Latif, N.A. Negm, M.T. Abou Kana, S.A. El-Daly and A.H. Elwahy, Sci. Rep. 12 (1), 19937 (2022). doi:10.1038/s41598-022-22311-z.
- F.M. Alkhatib and H.M. Alsulami, Heliyon. 9 (8) (2023). doi:10.1016/j.heliyon.2023.e18988.
- M. Amalanathann, D.M. Suresh, J.I. Hubert, J.V. Bena, S. Sebastian and S. Ayyapan, Pharm. Anal. Acta. 7, 1–8 (2016). doi:10.4172/2153-2435.1000457.
- J. Tirado-Rives and W.L. Jorgensen, J. Chem. Theory Comput. 4, 297–306 (2008). doi:10.1021/ct700248k.
- P. Vennila, M. Govindaraju, G. Venkatesh, C. Kamal, Y. Sheena Mary, C. Yohannan Panicker, S.A.V.A. Ş, S.A. Kaya and S.J. Armaković, J. Mol. Struct. 1151, 245–255 (2018). doi:10.1016/j.molstruc.2017.09.049.
- S. Armaković, S.J. Armaković, J.P. Šetrajčić and V. Holodkov, J. Mol. Model. 20, 2538 (2014). doi:10.1007/s00894-014-2538-4.
- S. Armaković, J.S. Armaković and P.J. Šetrajčić, Int. J. Hydrogen Energy. 38 (27), 12190–12198 (2013). doi:10.1016/j.ijhydene.2013.05.091.
- V.V. Aswathy, Y. Sheena Mary, P.J. Jojo, C. Yohannan Panicker, A. Bielenica, S. Armaković, S.J. Armaković, P. Brzózka, S. Krukowski and C. Van Alsenoy, J. Mol. Struct. 1134, 668–680 (2017). doi:10.1016/j.molstruc.2017.01.016.
- M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, G.A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. Marenich, J. Bloino, B.G. Janesko, R. Gomperts, B. Mennucci, H.P. Hratchian, J.V. Ortiz, A.F. Izmaylov, J.L. Sonnenberg, D. Williams-Young, F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, T. Henderson, D. Ranasinghe, V.G. Zakrzewski, J. Gao, N. Rega, G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, K. Throssell, J.A. Montgomery, Jr., J.E. Peralta, F. Ogliaro, M. Bearpark, J.J. Heyd, E. Brothers, K.N. Kudin, V.N. Staroverov, T. Keith, R. Kobayashi, J. Normand, K. Raghavachari, A. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, J.M. Millam, M. Klene, C. Adamo, R. Cammi, J.W. Ochterski, R.L. Martin, K. Morokuma, O. Farkas, J.B. Foresman and D.J. Fox, Gaussian 09, Revision B.01 (Gaussian, Inc., Wallingford, CT, 2010).
- T. Keith, R. Dennington and J. Millam, GaussView, Version 5 (Semichem Inc, Shawnee, 2009). <http://www.gaussian.com/g_tech/gv5ref/gv5citation.htm>.
- M.H. Jomroz, Vibrational Energy Distribution Analysis (VEDA4, Warsaw, 2004).
- T. Abbaz, A. Bendjeddou and D. Villemin, Pharm. Biol. Eval. 5, 27 (2018). doi:10.26510/2394-0859.pbe.2018.04.
- W. Kohn and L.J. Sham, Phys. Rev. 140, A1133–A1138 (1965). doi:10.1103/PhysRev.140.A1133.
- A.D. Becke, J. Chem. Phys. 98, 5648–5652 (1993). doi:10.1063/1.464913.
- C. Lee, W. Yang and R.G. Parr, Phys. Rev. B37, 785–789 (1988). doi:10.1103/PhysRevB.37.785.
- B. Miehlich, A. Savin, H. Stoll and H. Preuss, Chem. Phys. Lett. 157 (3), 200–206 (1989). doi:10.1016/0009-2614(89)87234-3.
- M.J. Frisch, Gaussion 09W, Revision A.02 (Gaussion Inc, Wallingford, CT, 2009).
- W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56 (5), 2257–2261 (1972). doi:10.1063/1.1677527.
- J.R. Cheeseman, G.W. Trucks, T.A. Keith and M.J. Frisch, J. Chem. Phys. 104, 5497–5509 (1996). doi:10.1063/1.471789.
- A. Apolonski, S. Roy, R. Lampe and K.S. Maiti, Multidiscip. Digit. Publ. Inst. Proc. 27 (1), 26 (2019).
- A.S. Kazachenko, F.N. Tomilin, A.A. Pozdnyakova, N.Y. Vasilyeva, Y.N. Malyar, S.A. Kuznetsova and P.V. Avramov, Chem. Pap. 74 (11), 4103–4113 (2020). doi:10.1007/s11696-020-01220-3.
- R. Kumar, T. Karthick, P. Tandon, P. Agarwal, A.P. Menezes and A. Jayarama, J. Mol. Struct. 1164, 180–190 (2018). doi:10.1016/j.molstruc.2018.03.060.
- T. Abbaz, A. Bendjeddou and D. Villemin, J. Sci. Eng. Res. 6 (2), 57–68 (2019).
- A. Prabakaran and S. Muthu, Acta A Mol. Biomol. Spectrosc. 99, 90–96 (2012). doi:10.1016/j.saa.2012.09.014.
- C. Karnan and A.R. Prabakaran, Int. J. Sci. Res. Phys. Appl. Sci. 7 (1), 46–51 (2019). doi:10.26438/ijsrpas/v7i1.4651.
- V. Choudhary, A. Bhatt, D. Dash and N. Sharma, J. Comput. Chem. (2019). doi:10.1002/jcc.26012.
- M. Arivazhagan, S. Jeyavijayan and J. Geethapriya, Spectrochim. Acta Part A. 104, 14–25 (2013). doi:10.1016/j.saa.2012.11.032.
- (a) M.J.S. Dewar, Angew. Chem. 10, 761 (1971). doi:10.1002/anie.197107611. (b) I. Willner and M. Rabinovitz, J. Org. Chem. 45, 1628 (1980) doi:10.1021/jo01297a018. (c) Y. Cohen, J. Klein and M. Rabinovitz, J. Chem. Soc. Chem. Commun, 1071 (1986) doi:10.1039/c39860001071. (d) Y. Cohen, N.H. Roelofs, G. Reinhard, L.T. Scott and M. Rabinovitz, J. Org. Chem. 52, 4207 (1987) doi:10.1021/jo00228a011.
- P. Geerlings, F. De Proft and W. Langenaeker, Chem. Rev. 103, 1793 (2003). doi:10.1021/cr990029p.
- M. Govindarajan, M. Karabacak, S. Periandy and D. Tanuja, Spectrochim. Acta A Mol. Biomol. Spectrosc. 97, 231 (2012). doi:10.1016/j.saa.2012.06.014.
- X. Cheng, J. Mol. Model. 22 (11) (2016). doi:10.1007/s00894-016-3151-5.
- G.-J. Zhao and K.-L. Han, Acc. Chem. Res. 45 (3), 404–413 (2011). doi:10.1021/ar200135h.
- N. Sundaraganesan, S. Illakiamani, C. Meganathan and B.D. Joshua, Spectrochim. Acta A. 67, 214–224 (2007). doi:10.1016/j.saa.2006.07.004.
- M. Silverstein, G.C. Basseler and C. Morill, Spectrometric Identification of Organic Compounds (Wiley, New York, 1981).
- B. Silvi and A. Savin, Nature. 371, 683–686 (1994). doi:10.1038/371683a0.
- H. Jacobsen, Can. J. Chem. 86 (7), 695–702 (2011). doi:10.1139/v08-052.
- R.G. Parr, R.A. Donnelly, M. Levy and W.E. Palke, J. Chem. Phys. 68 (8), 3801–3807 (1977). doi:10.1063/1.436185.
- A.D. Becke and K.E. Edgecombe, J. Chem. Phys. 92 (9), 5397–5403 (1990). doi:10.1063/1.458517.
- H. Jacobsen, J. Comput. Chem. 30 (7), 1093–1102 (2009). doi:10.1002/jcc.21135.
- B. Silvi and A. Savin, Nature. 371 (6499), 683–686 (1994). doi:10.1038/371683a0.
- H. Jacobsen, Can. J. Chem. 87 (7), 965–973 (2009). doi:10.1139/V09-060.
- A. Daina, O. Michielin and V. Zoete, Sci. Rep. 7, 42717 (2017). doi:10.1038/srep42717.
- C.A. Lipinski, F. Lombardo B, W. Dominy and P.J. Feeney, Adv. Drug Delivery Rev. 46 (1–3), 3–26 (2001). doi:10.1016/S0169-409X(00)00129-0.
- Y.C. Martin and A. Bioavailability Score, J. Med. Chem. 48 (9), 3164–3170 (2005). doi:10.1021/jm0492002.
- C.A. Redlich, W.S. Beckett, J. Sparer, K.W. Barwick, C.A. Riely, H. Miller, S.L. Sigal, S.L. Shalat and M.R. Cullen, Ann. Intern. Med. 108, 680–686 (1988). doi:10.7326/0003-4819-108-5-680.
- R. Wrbitzky, Int. Arch. Occup. Environ. Health. 72, 19–25 (1999). doi:10.1007/s004200050329.
- J.C. Luo, H.W. Kuo, T.J. Cheng and M.J.W. Chang, J. Occup. Environ. Med. 43, 474–482 (2001). doi:10.1097/00043764-200105000-00008. <http://www.jstor.org/stable/44995805>.
- Z. Zhou, L. Sang, J. Wang, L. Song, L. Zhu and Y. Wang, Ecotoxicol. Environ. Saf. 228, 112986 (2021). doi:10.1016/j.ecoenv.2021.112986.
- H. Jiang, X. Zhang, J. Shen, Y. Zhang, Y. Gu, T. Tian, M. Chu, X. Zhuang and Y. Lian, Int. Arch. Occup. Environ. Health. 92, 967–975 (2019). doi:10.1007/s00420-019-01436-1.
- M. Lawrence, P. Rajesh, M. Thirunavukkarasu and S. Muthu, J. Mol. Liq. 382, 121940 (2023). doi:10.1016/j.molliq.2023.121940.
- K. Vedhapriya, G. Balaji, S. Sakthivel, S. Javed, M. Thirunavukkarasu and S. Muthu, Chem. Phys Impact. 7, 100262 (2023). doi:10.1016/j.chphi.2023.100262.
- M. Thirunavukkarasu, P. Prabakaran and A. Saral, J. Mol. Liq. 380, 121714 (2023). doi:10.1016/j.molliq.2023.121714.
- P. Rajkumar, S. Selvaraj, P. Anthoniammal, A. Ram Kumar, K. Kasthuri and S. Kumaresan, Chem. Phys. Impact. 7, 100257 (2023). doi:10.1016/j.chphi.2023.100257.
- A. Ram Kumar, S. Selvaraj, P. Anthoniammal, R. Jothi Ramalingam, R. Balu, P. Jayaprakash and G.P. Sheeja Mol, J. Fluorine Chem. 270, 110167 (2023). doi:10.1016/j.jfluchem.2023.110167.
- S. Selvaraj, A. Ram Kumar, T. Ahilan, M. Kesavan, G. Serdaroglu, P. Rajkumar, M. Mani, S. Gunasekaran and S. Kumaresan, Phys. Chem. Res. 10 (3), 333–344 (2022). doi:10.22036/PCR.2021.304087.1966.
- K. Thirunavukkarasu, P. Rajkumar, S. Selvaraj, S. Gunasekaran and S. Kumaresan, Chem. Data Collect. 17–18, 263–275 (2018). doi:10.1016/j.cdc.2018.09.006.
- N. Kanagathara, M.K. Marchewka, M. Thirunavukkarasu, S. Selvaraj, J. Janczak and A.-Y. Lo, Mater. Chem. Phys. 307, 128166 (2023). doi:10.1016/j.matchemphys.2023.128166.
- S. Selvaraj, A. Ram Kumar, T. Ahilan, M. Kesavan, S. Gunasekaran and S. Kumaresan, J. Indian Chem. Soc. 99 (10), 100676 (2022). doi:10.1016/j.jics.2022.100676.
- F. Pretsch, P. Buhlman and C. Affolter, Structure Determination of Organic Compounds, Tables of Spectral Data (Springer, Berlin, 2009).
- K. R. Cousins, Computer review of ChemDraw Ultra 12.0. 2011.
- A. Saral, R. Shahidha and M. Thirunavukkarasu, Chem. Phys. Impact. 6, 100193 (2023). doi:10.1016/j.chphi.2023.100193.
- N. Kanagathara, M.K. Marchewka, M. Thirunavukkarasu, S. Selvaraj, J. Janczak and A.-Y. Lo, Mater. Chem. Phys. 307, 128166 (2023). doi:10.1016/j.matchemphys.2023.128166.
- N. Sheeja, G. Baskar and M. Thirunavukkarasu, J. Mol. Liq. 374, 121272 (2023). doi:10.1016/j.molliq.2023.121272.