Design, spectral characterization, quantum chemical investigation, biological activity of nano-sized transition metal complexes of tridentate 3-mercapto-4H-1,2,4-triazol-4-yl-aminomethylphenol Schiff base ligand

References

• A Patil, S., P Hoagland, A., A Patil, S., & Bugarin, A. (2020). N-heterocyclic carbene-metal complexes as bio-organometallic antimicrobial and anticancer drugs, an update (2015–2020). Future Medicinal Chemistry, 12(24), 2239–2275.
   PubMed Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Abu-Dief, A. A., Aboelez, M. O., & Abdel-Mawgoud, A. A. H. (2017). DNA interaction, antimicrobial, anticancer activities and molecular docking study of some new VO(II), Cr(III), Mn(II) and Ni(II) mononuclear chelates encompassing quaridentate imine ligand. Journal of Photochemistry and Photobiology. B, Biology, 170, 271–285. https://doi.org/10.1016/j.jphotobiol.2017.04.003
   PubMed Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Abu-Dief, A. A., El-Khatib, R. M., & Abdel-Fatah, S. R. (2016). Some new nano-sized Fe(II), Cd(II) and Zn(II) Schiff base complexes as precursor for metal oxides: Sonochemical synthesis, characterization, DNA interaction, in vitro antimicrobial and anticancer activities. Bioorganic Chemistry, 69, 140–152. https://doi.org/10.1016/j.bioorg.2016.10.009
   PubMed Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Abu-Dief, A. M., Basha, M., & Abdel-Mawgoud, A. A. H. (2017). Three novel Ni(II), VO(II) and Cr(III) mononuclear complexes encompassing potentially tridentate imine ligand: Synthesis, structural characterization, DNA interaction, antimicrobial evaluation and anticancer activity. Applied Organometalallic Chemistry, 31(11), e3570.
   Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Abu-Dief, A. M., Moustafa, H., & Abdel-Mawgoud, A. A. H. (2020). Design and nonlinear optical properties (NLO) using DFT approach of new Cr(III), VO(II), and Ni(II) chelates incorporating tri-dentate imine ligand for DNA interaction, antimicrobial, anticancer activities and molecular docking studies. Arabian Journal of Chemistry, 13(1), 649–670. https://doi.org/10.1016/j.arabjc.2017.07.007
   Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Abu-Dief, A. M., Shehata, M. R., & Atlam, F. M. (2019). Some new Ag(I), VO(II) and Pd(II) chelates incorporating tridentate imine ligand: Design, synthesis, structure elucidation, density functional theory calculations for DNA interaction, antimicrobial and anticancer activities and molecular docking studies. Applied Organometalallic Chemistry, 33(4), e4699.
   Web of Science ®Google Scholar
• Abdel-Rahman, L. H., Adam, M. S. S., Abu-Dief, A. M., Moustafa, H., Basha, M. T., Aboraia, A. S., Al-Farhan, B. S., & Ahmed, H. E. (2018). Synthesis, theoretical investigations, biocidal screening, DNA binding, in vitro cytotoxicity and molecular docking of novel Cu (II), Pd (II) and Ag (I) complexes of chlorobenzylidene Schiff base: Promising antibiotic and anticancer agents. Applied Organometalallic Chemistry, 32, e4527.
   Web of Science ®Google Scholar
• Abou-Hussein, A. A., & Linert, W. (2014). Synthesis, spectroscopic, coordination and biological activities of some organometallic complexes derived from thio-Schiff base ligands. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 117, 763–771. https://doi.org/10.1016/j.saa.2013.06.078
   PubMed Web of Science ®Google Scholar
• Abu-Dief, A. M., Alotaibi, N. H., Al-Farraj, E. S., Qasem, Alzahrani, S., Mahfouz, M. K., H. A., & Abdou, A. (2022). Fabrication, structural elucidation, theoretical, TD-DFT, vibrational calculation and molecular docking studies of some novel adenine imine chelates for biomedical applications. Journal of Molecular Liquids, 365(1), 119961. https://doi.org/10.1016/j.molliq.2022.119961
   Google Scholar
• Abu-Dief, A. M., El-Khatib, R. M., Aljohani, F. S., Al-Abdulkarim, H. A., Alzahrani, S., El-Sarrag, G., & Ismael, M. (2022). Synthesis, structural elucidation, DFT calculation, biological studies and DNA interaction of some aryl hydrazone Cr3+, Fe3+, and Cu2+ chelates. Computational Biology and Chemistry, 97, 107643. https://doi.org/10.1016/j.compbiolchem.2022.107643
   PubMed Web of Science ®Google Scholar
• Abu-Dief, A. M., El-Khatib, R. M., Aljohani, F. S., Alzahrani, S. O., Mahran, A., Khalifa, M. E., & El-Metwaly, N. M. (2021). Synthesis and intensive characterization for novel Zn(II), Pd(II), Cr(III) and VO(II)-Schiff base complexes; DNA-interaction, DFT, drug-likeness and molecular docking studies. Journal of Molecular Structure, 1242, 130693. https://doi.org/10.1016/j.molstruc.2021.130693
   Web of Science ®Google Scholar
• Abu-Dief, A. M., El-Khatib, R. M., El‐Dabea, T., Abdou, A., Aljohani, F. S., Al-Farraj, E. S., Barnawi, I. O., & El-Remaily, M. A. A. A. (2023). Fabrication, structural elucidation of some new metal chelates based on N-(1H-Benzoimidazol-2-yl)-guanidine ligand: DNA interaction, pharmaceutical studies and molecular docking approach. Journal of Molecular Liquids, 386, 122353. https://doi.org/10.1016/j.molliq.2023.122353
   Web of Science ®Google Scholar
• Abu-Dief, A. M., El-Metwaly, N. M., Alzahrani, S. O., Alkhatib, F., Abualnaja, M. M., Tarek, T., El-Dabea, M. A., & El-Remaily, A. (2021). Synthesis and characterization of Fe(III), Pd(II) and Cu(II)-thiazole complexes; DFT, pharmacophore modeling, in-vitro assay and DNA binding studies. Journal of Molecular Liquids, 326, 115277. https://doi.org/10.1016/j.molliq.2021.115277
   Web of Science ®Google Scholar
• Abu‐Dief, A. M., El‐Sagher, H. M., & Shehata, M. R. (2019). Fabrication, spectroscopic characterization, calf thymus DNA binding investigation, antioxidant and anticancer activities of some antibiotic azomethine Cu (II), Pd (II), Zn (II) and Cr (III) complexes. Applied Organometallic Chemistry, 33(8), e4943. https://doi.org/10.1002/aoc.4943
   Web of Science ®Google Scholar
• Abu-Dief, A. M., Torres, R. D., Sañudo, E. C., Abdel-Rahman, L. H., & Alcalde, N. A. (2013). Novel sandwich triple-decker dinuclear NdIII-(bis-N,N′-p-bromo-salicylideneamine-1,2-diaminobenzene) complex. Polyhedron, 64, 203–208. https://doi.org/10.1016/j.poly.2013.04.010
   Web of Science ®Google Scholar
• Aggoun, D., Fernández-García, M., López, D., Bouzerafa, B., Ouennoughi, Y., Setifi, F., & Ourari, A. (2020). New nickel (II) and copper (II) bidentate Schiff base complexes, derived from dihalogenated salicylaldehyde and alkylamine: Synthesis, spectroscopic, thermogravimetry, crystallographic determination and electrochemical studies. Polyhedron, 187, 114640. https://doi.org/10.1016/j.poly.2020.114640
   Web of Science ®Google Scholar
• Alaghaz, A.-N M., Zayed, M. E., Alharbi, S. A., Ammar, R. A., & Chinnathambi, A. (2015). Synthesis, spectroscopic identification, thermal, potentiometric and antibacterial activity studies of 4-amino-5-mercapto-S-triazole Schiff’s base complexes. Journal of Molecular Structure, 1087, 60–67. https://doi.org/10.1016/j.molstruc.2015.01.035
   Web of Science ®Google Scholar
• Alaghaz, A.-N. M., Zayed, M. E., & Alharbi, S. A. (2015). Synthesis, spectral characterization, molecular modeling, biological activity and potentiometric studies of 4-amino-5-mercapto-3-methyl-S-triazole Schiff’s base complexes. Journal of Molecular Structure, 1083, 430–440. https://doi.org/10.1016/j.molstruc.2014.10.076
   Web of Science ®Google Scholar
• Ali, A., Barman, S. K., & Mukherjee, R. (2015). Palladium (II) complex of a redox-active amidophenolate-based O, N, S, N ligand: Its monocation and dication and reactivity with PPh3. Inorganic Chemistry, 54(11), 5182–5194. https://doi.org/10.1021/ic503103e
   PubMed Web of Science ®Google Scholar
• Al‐Mohaimeed, A. M., Al‐Farraj, E. S., Al‐Onazi, W. A., Alothman, A. A., & Almarhoon, Z. M. (2020). Synthesis, characterization, density functional theory, thermal, antimicrobial efficacy, and DNA binding/cleavage studies of Cu (II), Cr (III), Fe (III), Ni (II), Co (II), Zn (II), and Pt (IV) complexes with a derivative of 2‐hydroxyphenoxymethylfuran‐5‐carbaldehyde. Journal of the Chinese Chemical Society, 67(11), 2100–2117. https://doi.org/10.1002/jccs.202000042
   Web of Science ®Google Scholar
• Al-Noor, T. H., Mohapatra, R. K., Azam, M., Karem, L. K. A., Mohapatra, P. K., Ibrahim, A. A., Parhi, P. K., Dash, G. C., El-Ajaily, M. M., Al-Resayes, S. I., Raval, M. K., & Pintilie, L. (2021). Mixed-ligand complexes of ampicillin derived Schiff base ligand and Nicotinamide: Synthesis, physico-chemical studies, DFT calculation, antibacterial study and molecular docking analysis. Journal of Molecular Structure, 1229, 129832. https://doi.org/10.1016/j.molstruc.2020.129832
   Web of Science ®Google Scholar
• Al-Qahtani, S. D., Alsoliemy, A., Almehmadi, S. J., Kholood Alkhamis, K., Abdulmajeed, F., Alrefaei, A. F., Rania Zaky, R., & Nashwa El-Metwaly, N. (2021). Green synthesis for new Co(II), Ni(II), Cu(II) and Cd(II) hydrazone-based complexes; characterization, biological activity and electrical conductance of nano-sized copper sulphate. Journal of Molecular Structure, 1244, 131238. https://doi.org/10.1016/j.molstruc.2021.131238
   Web of Science ®Google Scholar
• Ammar, R. A., Alaghaz, A.-N M., Zayed, M. E., & Al-Bedair, L. A. (2017). Synthesis, spectroscopic, molecular structure, antioxidant, antimicrobial and antitumor behavior of Mn (II), Co (II), Ni (II), Cu (II) and Zn (II) complexes of O2N type tridentate chromone-2-carboxaldehyde Schiff’s base ligand. Journal of Molecular Structure, 1141, 368–381. https://doi.org/10.1016/j.molstruc.2017.03.080
   Web of Science ®Google Scholar
• Bhale, S. P., Yadav, A. R., Pathare, P. G., Tekale, S. U., Franguelli, F. P., Kótai, L., & Pawar, R. P. (2020). Synthesis, characterization and antimicrobial activity of transition metal complexes of 4-[(2-Hydroxy-4-Methoxyphenyl) Methyleneamino]-2, 4-Dihydro-3h-1, 2, 4-Triazole-3-Thione. European Chemical Bulletin, 9(10–12), 430–435. https://doi.org/10.17628/ecb.2020.9.430-435
   Google Scholar
• Broido, A. (1976). Kinetics of solid-phase cellulose pyrolysis. In Thermal uses and properties of carbohydrates and lignins. Academic Press.
   Google Scholar
• Calu, L., Badea, M., Chifiriuc, M. C., Bleotu, C., David, G.-I., Ioniţă, G., Măruţescu, L., Lazăr, V., Stanică, N., Soponaru, I., Marinescu, D., & Olar, R. (2015). Synthesis, spectral, thermal, magnetic and biological characterization of Co (II), Ni (II), Cu (II) and Zn (II) complexes with a Schiff base bearing a 1, 2, 4-triazole pharmacophore. Journal of Thermal Analysis and Calorimetry, 120(1), 375–386. https://doi.org/10.1007/s10973-014-3970-5
   Web of Science ®Google Scholar
• Chattopadhyay, D. (2022). Cisplatin: Forty years of a serendipitous discovery for cancer. Resonance, 27(4), 659–666. https://doi.org/10.1007/s12045-022-1355-9
   Google Scholar
• Chaurasia, M., Tomar, D., & Chandra, S. (2019). Synthesis, spectral characterization, and DNA binding studies of Co (II), Ni (II), Cu (II) and Zn (II) complexes of Schiff base 2-((1H-1, 2, 4-triazol-3-ylimino) methyl)-5-methoxyphenol. Journal of Molecular Structure, 1179, 431–442. https://doi.org/10.1016/j.molstruc.2018.11.027
   Web of Science ®Google Scholar
• Coats, A. W., & Redfern, J. (1964). Kinetic parameters from thermogravimetric data. Nature, 201(4914), 68–69. https://doi.org/10.1038/201068a0
   Web of Science ®Google Scholar
• Dekar, S., Ouari, K., Bendia, S., Hannachi, D., & Weiss, J. (2018). Mononuclear oxovanadium (IV) Schiff base complex: Synthesis, spectroscopy, electrochemistry, DFT calculation and catalytic activity. Journal of Organometallic Chemistry, 866, 165–176. https://doi.org/10.1016/j.jorganchem.2018.04.015
   Web of Science ®Google Scholar
• Gadre, S. R., Suresh, C. H., & Mohan, N. (2021). Electrostatic potential topology for probing molecular structure, bonding and reactivity. Molecules (Basel, Switzerland), 26(11), 3289. https://doi.org/10.3390/molecules26113289
   PubMed Web of Science ®Google Scholar
• Gates-Rector, S., & Blanton, T. (2019). The powder diffraction file: A quality materials characterization database. Powder Diffraction, 34(4), 352–360. https://doi.org/10.1017/S0885715619000812
   Web of Science ®Google Scholar
• Ghanghas, P., Choudhary, A., Kumar, D., & Poonia, K. (2021). Coordination metal complexes with Schiff bases: Useful pharmacophores with comprehensive biological applications. Inorganic Chemistry Communications, 130, 108710. https://doi.org/10.1016/j.inoche.2021.108710
   Web of Science ®Google Scholar
• Gregoliński, J., Ślepokura, K., Kłak, J., & Witwicki, M. (2022). Multinuclear Ni (II) and Cu (II) complexes of a meso 6 + 6 macrocyclic amine derived from trans-1, 2-diaminocyclopentane and 2, 6-diformylpyridine. Dalton Transactions (Cambridge, England: 2003), 51(25), 9735–9747. https://doi.org/10.1039/d2dt01329k
   PubMed Web of Science ®Google Scholar
• Habib, A., Iqbal, M. A., Bhatti, H. N., & Shahid, M. (2019). Effect of ring substitution on synthesis of benzimidazolium salts and their silver (I) complexes: Characterization, electrochemical studies and evaluation of anticancer potential. Transition Metal Chemistry, 44(5), 431–443. https://doi.org/10.1007/s11243-019-00321-7
   Web of Science ®Google Scholar
• Hatakeyama, T., & Quinn, F. (1999). Thermal analysis: Fundamentals and applications to polymer science. Chichester: John Wiley. [sl].
   Google Scholar
• Hathaway, B., & Tomlinson, A. (1970). Copper (II) ammonia complexes. Coordination Chemistry Reviews, 5(1), 1–43. https://doi.org/10.1016/S0010-8545(00)80073-9
   Web of Science ®Google Scholar
• Horowitz, H. H., & Metzger, G. (1963). A new analysis of thermogravimetric traces. Analytical Chemistry, 35(10), 1464–1468. https://doi.org/10.1021/ac60203a013
   Web of Science ®Google Scholar
• Hourahine, B., Aradi, B., Blum, V., Bonafé, F., Buccheri, A., Camacho, C., Cevallos, C., Deshaye, M. Y., Dumitrică, T., Dominguez, A., Ehlert, S., Elstner, M., van der Heide, T., Hermann, J., Irle, S., Kranz, J. J., Köhler, C., Kowalczyk, T., Kubař, T., … Frauenheim, T. (2020). DFTB+, a software package for efficient approximate density functional theory based atomistic simulations. The Journal of Chemical Physics, 152(12), 124101. https://doi.org/10.1063/1.5143190
   PubMed Web of Science ®Google Scholar
• Jeyaraman, P., Alagarraj, A., & Natarajan, R. (2019). In silico and in vitro studies of transition metal complexes derived from curcumin–isoniazid Schiff base. Journal of Biomolecular Structure & Dynamics, 38(2), 488–499. https://doi.org/10.1080/07391102.2019.1581090
   PubMed Web of Science ®Google Scholar
• Karzazi, Y., Belghiti, M. E., El-Hajjaji, F. & Hammouti B. (2016). Density functional theory modeling and Monte Carlo simulation assessment of N-substituted quinoxaline derivatives as mild steel corrosion inhibitors in acidic medium. Journal of Materials and Environmental Science, 7(10), 3916–3929.
   Google Scholar
• Liu, X., Manzur, C., Novoa, N., Celedón, S., Carrillo, D., & Hamon, J.-R. (2018). Multidentate unsymmetrically-substituted Schiff bases and their metal complexes: Synthesis, functional materials properties, and applications to catalysis. Coordination Chemistry Reviews, 357, 144–172. https://doi.org/10.1016/j.ccr.2017.11.030
   Web of Science ®Google Scholar
• Mahmoud, N. F., Abbas, A. A., & Mohamed, G. G. (2021). Synthesis, characterization, antimicrobial, and MOE evaluation of nano 1, 2, 4‐triazole‐based Schiff base ligand with some d‐block metal ions. Applied Organometallic Chemistry, 35(6), e6219. https://doi.org/10.1002/aoc.6219
   Web of Science ®Google Scholar
• Maravalli, P., & Goudar, T. (1999). Thermal and spectral studies of 3-N-methyl-morpholino-4-amino-5-mercapto-1, 2, 4-triazole and 3-N-methyl-piperidino-4-amino-5-mercapto-1, 2, 4-triazole complexes of cobalt (II), nickel (II) and copper (II). Thermochimica Acta, 325(1), 35–41. https://doi.org/10.1016/S0040-6031(98)00548-6
   Web of Science ®Google Scholar
• Mohamad, A. D. M., Abualreish, M. J. A., & Abu-Dief, A. A. (2015). Antimicrobial and anticancer activities of cobalt (III)-hydrazone complexes: Solubilities and chemical potentials of transfer in different organic co-solvent-water mixtures. Journal of Molecular Liquids, 290, 111162. https://doi.org/10.1016/j.molliq.2019.111162
   Google Scholar
• Mohapatra, R. K., El-Ajaily, M. M., Alassbaly, F. S., Sarangi, A. K., Das, D., Maihub, A. A., Ben-Gweirif, S. F., Mahal, A., Suleiman, M., Perekhoda, L., Azam, M., & Al-Noor, T. H. (2021). DFT, anticancer, antioxidant and molecular docking investigations of some ternary Ni (II) complexes with 2-[(E)-[4-(dimethylamino) phenyl] methyleneamino] phenol. Chemical Papers, 75(3), 1005–1019. https://doi.org/10.1007/s11696-020-01342-8
   Web of Science ®Google Scholar
• Pardasani, R., & Pardasani, P. (2021). Magnetic properties of copper (II) chloro complex with 5-(2-hydroxy-phenylazo)-2-thiohydantoin, in magnetic properties of paramagnetic compounds, magnetic susceptibility data, Volume 4: A Supplement to Landolt-Börnstein II/31 Series (p. 157–158). Springer.
   Google Scholar
• Piloyan, G., Ryabchikov, I., & Novikova, O. (1966). Determination of activation energies of chemical reactions by differential thermal analysis. Nature, 212(5067), 1229–1229. https://doi.org/10.1038/2121229a0
   Web of Science ®Google Scholar
• Poyraz, S., Belveren, S., Aydınoğlu, S., Ulger, M., de Cózar, A., de Gracia Retamosa, M., Sansano, J. M., & Döndaş, H. A. (2021). Biological properties and conformational studies of amphiphilic Pd (II) and Ni (II) complexes bearing functionalized aroylaminocarbo-N-thioylpyrrolinate units. Beilstein Journal of Organic Chemistry, 17(1), 2812–2821. https://doi.org/10.3762/bjoc.17.192
   PubMedGoogle Scholar
• Qin, Y.-L. (2016). A cyanide-bridged heterometallic coordination polymer constructed from square-planar [Ni (CN) 4] 2−: synthesis, crystal structure, thermal decomposition, electron paramagnetic resonance (EPR) spectrum and magnetic properties. Acta Crystallographica Section C: Structural Chemistry, 72(7), 555–560.
   PubMedGoogle Scholar
• Rosenberg, B., VanCamp, L., Trosko, J. E., & Mansour, V. H. (1969). Platinum compounds: A new class of potent antitumour agents. Nature, 222(5191), 385–386. https://doi.org/10.1038/222385a0
   PubMed Web of Science ®Google Scholar
• Saha, U., Chatterjee, S., Dolai, M., & Kumar, G. S. (2020). Biophysical and thermodynamic investigations on the differentiation of fluorescence response towards interaction of DNA: A pyrene-based receptor versus its Fe (III) complex. ACS Applied Bio Materials, 3(11), 7810–7820. https://doi.org/10.1021/acsabm.0c00983
   PubMedGoogle Scholar
• Saha, U., Dolai, M., & Kumar, G. S. (2020). Targeting nucleic acid with a bioactive fluorophore: Insights from spectroscopic and calorimetric studies. Journal of Molecular Structure, 1220, 128690. https://doi.org/10.1016/j.molstruc.2020.128690
   Web of Science ®Google Scholar
• Saha, U., Dolai, M., Kumar, G. S., Butcher, R. J., & Konar, S. (2020). New DNA-interactive manganese(II) complex of amidooxime: Crystal structure, DFT calculation, biophysical and molecular docking studies. Journal of Chemical & Engineering Data, 65(11), 5393–5404. https://doi.org/10.1021/acs.jced.0c00529
   Web of Science ®Google Scholar
• Saha, U., Palmajumder, E., & Mukherjea, K. K. (2016). Synthesis, structure, DNA binding studies and nuclease activities of two luminescent neodymium complexes. Journal of Coordination Chemistry, 69(19), 2920–2941. https://doi.org/10.1080/00958972.2016.1218483
   Web of Science ®Google Scholar
• Sakthi, M., & Ramu, A. (2017). Synthesis, structure, DNA/BSA binding and antibacterial studies of NNO tridentate Schiff base metal complexes. Journal of Molecular Structure, 1149, 727–735. https://doi.org/10.1016/j.molstruc.2017.08.040
   Web of Science ®Google Scholar
• Samy, M. E.-M., & Moamen, S. R. (2020). Synthesis and spectroscopic characterizations of New Mercury (II), Cerium (III), and Thorium (IV) captopril drug complexes. 光谱学与光谱分析, 40(11), 3649.
   Google Scholar
• Shahabadi, N., Darabi, F., Maghsudi, M., & Kashanian, S. (2010). DNA binding and gel electrophoresis studies of a copper (II) complex containing mixed aliphatic and aromatic dinitrogen ligands. DNA and Cell Biology, 29(6), 329–336. https://doi.org/10.1089/dna.2009.1001
   PubMed Web of Science ®Google Scholar
• Sharfalddin, A. A., Emwas, A.-H., Jaremko, M., & Hussien, M. A. (2021). Synthesis and theoretical calculations of metal-antibiotic chelation with thiamphenicol: In vitro DNA and HSA binding, molecular docking, and cytotoxicity studies. New Journal of Chemistry, 45(21), 9598–9613. https://doi.org/10.1039/D1NJ00293G
   Web of Science ®Google Scholar
• Shoemaker, D. P., Garland, C. W., & Steinfeld, J. I. (2018). Experiments in physical chemistry. McGraw-Hill.
   Google Scholar
• Singh, A., & Barman, P. (2021). Recent advances in schiff base ruthenium metal complexes: Synthesis and applications. Topics in Current Chemistry, 379(4), 1–71. https://doi.org/10.1007/s41061-021-00342-w
   Web of Science ®Google Scholar
• Smeets, E. W., Voss, J., & Kroes, G.-J. (2019). Specific reaction parameter density functional based on the meta-generalized gradient approximation: Application to H2+ Cu (111) and H2+ Ag (111). The Journal of Physical Chemistry. A, 123(25), 5395–5406. https://doi.org/10.1021/acs.jpca.9b02914
   PubMed Web of Science ®Google Scholar
• Stevens, K., & Pryce, M. H. L. (1953). On the magnetic properties of covalent XY 6 complexes. Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 219(1139), 542–555.
   Google Scholar
• Tarai, S. K., Mandal, S., Tarai, A., Som, I., Pan, A., Bagchi, A., Biswas, A., & Moi, S. C. (2023). Biophysical study on DNA and BSA binding activity of Cu(II) complex: Synthesis, molecular docking, cytotoxic activity, and theoretical approach. Applied Organometallic Chemistry, 37(8), e7164. https://doi.org/10.1002/aoc.7164
   Web of Science ®Google Scholar
• Tarai, S., et al. (2023). Bioactivity, molecular docking and anticancer behavior of pyrrolidine based Pt(II) complexes: Their kinetics, DNA and BSA binding study by spectroscopic methods. Spectrochimica Acta A: Molecular and Biomolecular Spectroscopy, 287(1), 122059.
   PubMedGoogle Scholar
• Tyagi, P., Chandra, S., Saraswat, B. S., & Sharma, D. (2015). Design, spectral characterization, DFT and biological studies of transition metal complexes of Schiff base derived from 2-aminobenzamide, pyrrole and furan aldehyde. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 143, 1–11. https://doi.org/10.1016/j.saa.2015.02.027
   PubMed Web of Science ®Google Scholar
• Tyagi, P., Tyagi, M., Agrawal, S., Chandra, S., Ojha, H., & Pathak, M. (2017). Synthesis, characterization of 1, 2, 4-triazole Schiff base derived 3d-metal complexes: Induces cytotoxicity in HepG2, MCF-7 cell line, BSA binding fluorescence and DFT study. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 171, 246–257. https://doi.org/10.1016/j.saa.2016.08.008
   PubMed Web of Science ®Google Scholar
• Urmila, S., Dolai, M., Konar, S., Das, A., Butcher, R. J., Kumar, G. S., & Mukhopadhyay, S. (2021). Design and synthesis of a sulphur containing Schiff base drug: DNA binding studies and theoretical calculations. Journal of Biomolecular Structure & Dynamics, 39(1), 263–271. https://doi.org/10.1080/07391102.2019.1708799
   PubMed Web of Science ®Google Scholar
• Yadav, M. (2012). Synthesis, characterization, and biological activity of some transition metal complexes of N-Benzoyl-N′-2-thiophenethiocarbohydrazide. International Journal of Inorganic Chemistry, 2012, 1–8. https://doi.org/10.1155/2012/269497
   Google Scholar
• Zhang, Z., Ma, Y., Bu, X., Wu, Q., Hang, Z., Dong, Z., & Wu, X. (2018). Facile one-step synthesis of TiO2/Ag/SnO2 ternary heterostructures with enhanced visible light photocatalytic activity. Scientific Reports, 8(1), 10532. https://doi.org/10.1038/s41598-018-28832-w
   PubMedGoogle Scholar
• Zhao, Y., Li, Z., Li, H., Wang, S., & Niu, M. (2018). Synthesis, crystal structure, DNA binding and in vitro cytotoxicity studies of Zn (II) complexes derived from amino-alcohol Schiff-bases. Inorganica Chimica Acta, 482, 136–143. https://doi.org/10.1016/j.ica.2018.06.008
   Web of Science ®Google Scholar