Abstract
The present work deals with the study of chemical synthesis of tetrabutylammonium hexanitrate Ce(III) (TBA3[Ce(NO3)6]) derived from ammonium cerium (IV) nitrate, syn-2-pyridinealdoxime, tetrabutylammonium bromide in 6:9:4 stoichiometric ratio and a mixture of acetic acid and water (10/30, v/v) in a single pot reaction. The structure of the TBA3[Ce(NO3)6] is characterized using FTIR, UV–Visible and Single X-ray Crystallography technique. Its crystal structure and BVS calculation confirm the oxidation state of cerium ion. The complex TBA3[Ce(NO3)6] consists of central metal atom cerium (III) ion, which was bound to six nitrate moieties through the coordinate bond with an oxygen atom and the whole moiety is surrounded by three tetrabutylammonium anions and formulates a salt structure. The symmetry point group of complex TBA3[Ce(NO3)6] is P21/n (14). From optical measurement, we have calculated the band gap energy of TBA3[Ce(NO3)6] (4.3 eV), which indicates the complex has semiconductor properties. We have also reported the binding ability of TBA3[Ce(NO3)6] with CT-DNA through intercalation mode, and the binding constant (Kb) is found to be 1.182 × 103 M−1. The cytotoxicity effect and chromosomal aberration in Allium cepa L. root tip cells confirmed the complex's biological activity. Density Function Theory (DFT) is finding out the theoretical evidence of structural and electronic parameters of the complex (by using cif) such as ionization potential (I), electron affinity (A), HOMO–LUMO energy gap, hardness (η) and softness (σ). The EHOMO, ELUMO, hardness (η), softness (σ) and dipole moment (µ) are − 3.442 eV, − 2.231 eV, 1.211 eV, 0.603 eV, 1.657 eV−1, and 3.830 Debye.
Graphical abstract
This is a preview of subscription content, log in via an institution to check access.
Similar content being viewed by others
References
Abdel-Mottaleb MS, Saif M, Attia MS, Abo-Aly MM, Mobarez SN (2018) Lanthanide complexes of spiropyran photoswitch and sensor: spectroscopic investigations and computational modelling. Photochem Photobiol Sci 17(2):221–230. https://doi.org/10.1039/C7PP00226B
Abraham S (1997) Studies on cytological changes induced by muriate of potash in Allium cepa. Cyto 162(3):291–294. https://doi.org/10.1508/cytologia.62.291
Ahmed AH, Hassan AM, Gumaa HA, Mohamed BH, Eraky AM, Omran AA (2019) Copper (II)-oxaloyldihydrazone complexes: Physico-chemical studies: Energy band gap and inhibition evaluation of free oxaloyldihydrazones toward the corrosion of copper metal in acidic medium. Arab J Chem 12(8):4287–4302. https://doi.org/10.1016/j.arabjc.2016.05.015
Akinboro A, Bakare AA (2007) Cytotoxic and genotoxic effects of aqueous extracts of five medicinal plants on Allium cepa Linn. J Ethnopharmacol 112(3):470–475. https://doi.org/10.1016/j.jep.2007.04.014
Akl MA, El-Gharkawy ESR, El-Mahdy NA, El-Sheikh SM, Sheta SM (2020) A novel nano copper complex: potentiometry, DFT and application as a cancer prostatic biomarker for the ultrasensitive detection of human PSA. Dalton Trans 49(44):15769–15778. https://doi.org/10.1039/D0DT03318A
Alberti E, Zampakou M, Donghi D (2016) Covalent and non-covalent binding of metal complexes to RNA. J Inorg Biochem 163:278–291. https://doi.org/10.1016/j.jinorgbio.2016.04.021
Bakare AA, Mosuro AA, Osibanjo O (2000) Effect of simulated leachate on chromosomes and mitosis in roots of Allium cepa (L.). J Environ Biol (3):263–271. https://www.researchgate.net/publication/251549713_Effect_of_simulated_leachate_on_chromosomes_and_mitosis_in_roots_of_Allium_cepaL.
Banerjee S, Ghorai P, Brandão P, Ghosh D, Bhuiya S, Chattopadhyay D, Das S, Saha A (2018) Syntheses, crystal structures, DNA binding, DNA cleavage, molecular docking and DFT study of Cu (II) complexes involving N 2 O 4 donor azo Schiff base ligands. New J Chem 42(1):246–259. https://doi.org/10.1039/C7NJ03293E
Becke AD (1992) Density-functional thermochemistry. I. The effect of the exchange-only gradient correction. J Chem Phys 196(3):2155–2160. https://doi.org/10.1063/1.462066
Bhattacharyya S, Dixit M (2011) Metallic radionuclides in the development of diagnostic and therapeutic radiopharmaceuticals. Dalton Trans 40(23):6112–6128. https://doi.org/10.1039/C1DT10379B
Bhatta P, Sakya SR (2009) Study of mitotic activity and chromosomal behaviour in root meristem of Allium cepa L. treated with magnesium sulphate. Ecoprint 15:83–88. https://doi.org/10.3126/eco.v15i0.1947
Bruker AP, Saint AX. Inc., Madison, WI (2004) Search PubMed.
Brown ID, Altermatt D (1985) Bond-valence parameters obtained from a systematic analysis of the Inorganic Crystal Structure Database. Acta Cryst B 41:244–247. https://doi.org/10.1107/S0108768185002063
Bogart JA, Lewis AJ, Boreen MA, Lee HB, Medling SA, Carroll PJ, Booth CH, Schelter EJ (2015) A ligand field series for the 4f-block from experimental and DFT computed Ce (IV/III) electrochemical potentials. Inorg Chem 54(6):2830–2837. https://doi.org/10.1021/ic503000z
Bogart JA, Lewis AJ, Medling SA, Piro NA, Carroll PJ, Booth CH, Schelter EJ (2013) Homoleptic cerium (III) and cerium (IV) nitroxide complexes: significant stabilization of the 4+ oxidation state. Inorg Chem 52(19):11600–116007. https://doi.org/10.1021/ic401974t
Chandraker SK, Singh P, Pandey B (2014) Clastogenic effect of soft drink on root tip of Allium cepa. Int J Curr Microbiol App Sci 3(5):200–206. https://www.ijcmas.com/vol-3-5/Sandip%20Kumar%20Chandraker,%20et%20al.pdf.
Chandraker SK, Lal M, Dhruve P, Singh RP, Shukla R (2021) Cytotoxic, Antimitotic, DNA binding, Photocatalytic, H2O2 sensing, and Antioxidant properties of biofabricated silver nanoparticles using leaf extract of Bryophyllum pinnatum (Lam.) Oken. Front Mol Biosci 7:465. https://doi.org/10.3389/fmolb.2020.593040
Cotelle S, Masfaraud JF, Férard JF (1999) Assessment of the genotoxicity of contaminated soil with the Allium/Vicia-micronucleus and the Tradescantia-micronucleus assays. Mutat Res-Fundam Mol Mech Mutagen 426(2):167–171. https://doi.org/10.1016/S0027-5107(99)00063-9
El-Barasi NL, Miloud MM, El-ajaily MM, Mohapatra RK, Sarangi AK, Das D, Mahal A, Parhi PK, Pintilie L, Barik SR, Bitu MN, Kudrat-E-Zahan M, Tabassum Z, Al-Resayes SI, Azam M (2020) Synthesis, structural investigations and antimicrobial studies of hydrazone based ternary complexes with Cr(III), Fe(III) and La(III) ions. J Soudi Chem Soc 24(6):492–503. https://doi.org/10.1016/j.jscs.2020.04.005
Esmaeili E, Salavati-Niasari M, Mohandes F, Davar F, Seyghalkar H (2011) Modified single-phase hematite nanoparticles via a facile approach for large-scale synthesis. Chem Eng J 170(1):278–285. https://doi.org/10.1016/j.cej.2011.03.010
Erxleben A (2017) Investigation of non-covalent interactions of metal complexes with DNA in cell-free systems. Chimia Int J Chem 71(3):102–111. https://doi.org/10.2533/chimia.2017.102
Farrugia LJ (2012) WinGX and ORTEP for Windows: an update. J Appl Crystallogr 45(4):849–854. https://doi.org/10.1107/S0021889812029111
Farrugia LJ (2013) WinGX, version 3 department of chemistry. University of Glasgow, Glasgow, Scotland
Fiskesjö G (1985) The Allium test as a standard in environmental monitoring. Hereditas 102(1):99–112. https://doi.org/10.1111/j.1601-5223.1985.tb00471.x
Ferraro D, Tredici IG, Ghigna P, Castillio-Michel H, Falqui A, Di Benedetto C, Alberti G, Ricci V (2017) Anselmi-Tamburini U, Sommi P. Dependence of the Ce (III)/Ce (IV) ratio on intracellular localization in ceria nanoparticles internalized by human cells. Nanoscale 9(4):1527–1538. https://doi.org/10.1039/C6NR07701C
Fliszár S (2012) Charge distributions and chemical effects: a new approach to the electronic structure and energy of molecules. Springer, Berlin. https://doi.org/10.1007/978-1-4612-5575-8_1
Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Scalmani G, Barone V, Mennucci B, Petersson G, Nakatsuji H (2009). gaussian 09, Revision d. 01, Gaussian. Inc., Wallingford CT. 201.
Ghosh MK, Jana B, Ghorai TK (2020a) Single molecule magnets of Co2 and Co2La MOFs synthesized by new Schiff base ligand N, N′-bis (o-Vanillinidene) Ethylenediamine (o-VEDH2). Front Chem. https://doi.org/10.3389/fchem.2020.571223
Ghosh MK, Pathak S, Ghorai TK (2019) Synthesis of two mononuclear schiff base metal (M= Fe, Cu) complexes: MOF structure, dye degradation, H2O2 sensing, and DNA binding property. ACS Omega 4(14):16068–16079. https://doi.org/10.1021/acsomega.9b02268
Ghosh MK, Chandraker SK, Shukla R, Mandal M, Mandal V, Ghorai TK (2020b) Molecular interaction, antimicrobial, antioxidant, cytotoxic and magnetic properties of Mn12 benzoate. J Clust Sci 31(3):575–589. https://doi.org/10.1007/s10876-019-01633-5
Ghosh MK, Giri S, Ghorai TK (2020c) Single pot reaction of Co (III) and Ni (II) hydrogen-bonded organic frameworks and multidisciplinary application in dye adsorption, separation and DNA binding. J Mol Struct 1206:127727. https://doi.org/10.1016/j.molstruc.2020.127727
Hemmert C, Pitié M, Renz M, Gornitzka H, Soulet S, Meunier B (2001) Preparation, characterization and crystal structures of manganese (II), iron (III) and copper (II) complexes of the bis [di-1, 1-(2-pyridyl) ethyl] amine (BDPEA) ligand; evaluation of their DNA cleavage activities. J Biol Inorg Chem 6(1):14–22. https://doi.org/10.1007/s007750000177
Hu A, Chen Y, Guo JJ, Yu N, An Q, Zuo Z (2018) Cerium-catalyzed formal cycloaddition of cycloalkanols with alkenes through dual photoexcitation. J Am Chem Soc 140(42):13580–13585. https://doi.org/10.1021/jacs.8b08781
Ji P, Sawano T, Lin Z, Urban A, Boures D, Lin W (2016) Cerium-hydride secondary building units in a porous metal–organic framework for catalytic hydroboration and hydrophosphination. J Am Chem Soc 138(45):14860–14863. https://doi.org/10.1021/jacs.6b10055
Jug K, Maksic ZB (1991) Theoretical models of chemical bonding. In: Maksi ZB (ed), Springer, Heidelberg, Vol. II, p. 77.
Kamble GC, Patil AS (2014) Comparative mutagenicity of EMS and gamma radiation in wild chickpea. Int J Sci 3:166–80. https://citeseerx.ist.psu.edu/viewdoc/download? doi=10.1.1.677.576&rep=rep1&type=pdf.
Konovalov B, Živković MD, Milovanović JZ, Djordjević DB, Arsenijević AN, Vasić IR, Janjić GV, Franich A, Manojlović D, Skrivanj S, Milovanović MZ (2018) Synthesis, cytotoxic activity and DNA interaction studies of new dinuclear platinum (ii) complexes with an aromatic 1, 5-naphthyridine bridging ligand: DNA binding mode of polynuclear platinum (ii) complexes in relation to the complex structure. Dalton Trans 47(42):15091–15102. https://doi.org/10.1039/C8DT01946K
Kostova I, Manolov I, Momekov G, Tzanova T, Konstantinov S, Karaivanova M (2005) Cytotoxic activity of new cerium (III) complexes of bis-coumarins. European J Med Chem 40(12):1246–1254. https://doi.org/10.1016/j.ejmech.2005.07.010
Kumari M, Kumari SI, Grover P (2014) Genotoxicity analysis of cerium oxide micro and nanoparticles in Wistar rats after 28 days of repeated oral administration. Mutagenesis 29(6):467–479. https://doi.org/10.1093/mutage/geu038
Kumari M, Khan SS, Pakrashi S, Mukherjee A, Chandrasekaran N (2011) Cytogenetic and genotoxic effects of zinc oxide nanoparticles on root cells of Allium cepa. J Hazard Mater 190(1–3):613–621. https://doi.org/10.1016/j.jhazmat.2011.03.095
Kumar DS, Chakrabarty D, Verma AK, Banerji BK (2011) Gamma ray induced chromosomal aberrations and enzyme related defense mechanism in Allium cepa L. Caryologia 64(4):388–397. https://doi.org/10.1080/00087114.2011.10589806
Khélifa AB, Belkhiria MS, Huang G, Freslon S, Guillou O, Bernot K (2015) Single-molecule magnet behaviour in polynuclear assembly of trivalent cerium ions with polyoxomolybdates. Dalton Trans 44(37):16458–16464. https://doi.org/10.1039/C5DT02377G
Lammer AD, Thiabaud G, Brewster JT, Alaniz J, Bender JA, Sessler JL (2018) Lanthanide texaphyrins as photocatalysts. Inorg Chem 57(6):3458–3464. https://doi.org/10.1021/acs.inorgchem.8b00248
Leng KM, Vijayarathna S, Jothy SL, Sasidharan S, Kanwar JR (2018) In vitro and in vivo toxicity assessment of alginate/eudragit S 100-enclosed chitosan–calcium phosphate-loaded iron saturated bovine lactoferrin nanocapsules (Fe-bLf NCs). Biomed Pharmacother 97:26–37. https://doi.org/10.1016/j.biopha.2017.10.121
Li Y, Yang ZY, Wang MF (2009) Synthesis, characterization, DNA binding properties and antioxidant activity of Ln (III) complexes with hesperetin-4-one-(benzoyl) hydrazone. Eur J Med Chem 44(11):4585–4595. https://doi.org/10.1016/j.ejmech.2009.06.027
Liman R, Acikbas Y, Ciğerci İH (2019) Cytotoxicity and genotoxicity of cerium oxide micro and nanoparticles by Allium and Comet tests. Ecotoxicol Environ Safety 30(168):408–414. https://doi.org/10.1016/j.ecoenv.2018.10.088
Long J, Lyubov DM, Mahrova TV, Cherkasov AV, Fukin GK, Guari Y, Larionova J, Trifonov AA (2018) Synthesis, structure and magnetic properties of tris (pyrazolyl) methane lanthanide complexes: effect of the anion on the slow relaxation of magnetization. Dalton Trans 47(15):5153–5156. https://doi.org/10.1039/C8DT00458G
Martins DA, Gouvea LR, Batista DD, Da Silva PB, Louro SR, Maria de Nazaré CS, Teixeira LR (2012) Copper (II)–fluoroquinolone complexes with anti-Trypanosoma cruzi activity and DNA binding ability. Biometals 25(5):951–960. https://doi.org/10.1007/s10534-012-9565-3
Mohapatra RK, Perekhoda L, Azam M, Suleiman M, Sarangi AK, Semenets A, Pintilie L, Al-Resayes SI (2021) Computational investigations of three main drugs and their comparison with synthesized compounds as potent inhibitors of SARS-CoV-2 main protease (Mpro): DFT, QSAR, molecular docking, and in silico toxicity analysis. J King Saud Univ Sci 33(2):101315. https://doi.org/10.1016/j.jksus.2020.101315
Nagae H, Aoki R, Akutagawa SN, Kleemann J, Tagawa R, Schindler T, Choi G, Spaniol TP, Tsurugi H, Okuda J, Mashima K (2018) Lanthanide complexes supported by a trizinc crown ether as catalysts for alternating copolymerization of epoxide and CO2: telomerization controlled by carboxylate anions. Angew Chem Int Ed 57(9):2492–2496. https://doi.org/10.1002/anie.201709218
Niroomand S, Khorasani-Motlagh M, Noroozifar M, Jahani S, Moodi A (2017) Photochemical and DFT studies on DNA-binding ability and antibacterial activity of lanthanum (III)-phenanthroline complex. J Mol Struct 15(1130):940–950. https://doi.org/10.1016/j.molstruc.2016.10.076
Parr RG (1980) Density functional theory of atoms and molecules. In: Horizons of quantum chemistry, Springer, Dordrecht. https://doi.org/10.1007/978-94-009-9027-2_2
Pathak S, Ghosh MK, Ghorai TK (2018) Luminescence, dye degradation and DNA binding properties of a Dinuclear nona-coordinated Y (III) complex. ChemistrySelect 3(47):13501–13506. https://doi.org/10.1002/slct.201801826
Pathak S, Ghosh MK, Mandal M, Mandal V, Bhattacharyya A, Ghorai TK (2019) Synthesis of a new acetate bridged Cu (ii) building block generated 1D polymer and studies on structural, magnetic, antibacterial and anticancer properties. New J Chem 43(4):2019–2029. https://doi.org/10.1039/C8NJ04937H
Pearson RG (1985) Absolute electronegativity and absolute hardness of Lewis acids and bases. J Am Chem Soc 107(24):6801–6806. https://doi.org/10.1021/ja00310a009
Procházková S, Kubíček V, Kotek J, Vágner A, Notni J, Hermann P (2018) Lanthanide (III) complexes of monophosphinate/monophosphonate DOTA-analogues: effects of the substituents on the formation rate and radiolabelling yield. Dalton Trans 47(37):13006–13015. https://doi.org/10.1039/C8DT02608D
Qiao Y, Cheisson T, Manor BC, Carroll PJ, Schelter EJ (2019) A strategy to improve the performance of cerium (III) photocatalysts. Chem Commun 55(28):4067–4070. https://doi.org/10.1039/C9CC00282K
Salavati-Niasari M, Davar F, Fereshteh Z (2009a) Synthesis and characterization of ZnO nanocrystals from thermolysis of new precursor. Chem Eng J 146(3):498–502. https://doi.org/10.1016/j.cej.2008.09.042
Salavati-Niasari M, Banitaba SH (2003) Alumina-supported Mn (II), Co (II), Ni (II) and Cu (II) bis (2-hydroxyanil) acetylacetone complexes as catalysts for the oxidation of cyclohexene with tert-butylhydroperoxide. J Mol Catal a: Chem 201(1–2):43–54. https://doi.org/10.1016/S1381-1169(03)00128-6
Salavati-Niasari M, Davar F, Mazaheri M (2009b) Synthesis and characterization of ZnS nanoclusters via hydrothermal processing from [bis (salicylidene) zinc (II)]. J Alloys Compd 470(1–2):502–506. https://doi.org/10.1016/j.jallcom.2008.03.048
Salavati-Niasari M, Shakouri-Arani M, Davar F (2008) Flexible ligand synthesis, characterization and catalytic oxidation of cyclohexane with host (nanocavity of zeolite-Y)/guest (Mn (II), Co (II), Ni (II) and Cu (II) complexes of tetrahydro-salophen) nanocomposite materials. Micropor Mesopor Mat 116(1–3):77–85. https://doi.org/10.1016/j.micromeso.2008.03.015
Sıdır İ, Sıdır YG, Kumalar M, Taşal E (2010) Ab initio Hartree-Fock and density functional theory investigations on the conformational stability, molecular structure and vibrational spectra of 7-acetoxy-6-(2, 3-dibromopropyl)-4, 8-dimethylcoumarin molecule. J Mol Struct 964(1–3):134–151. https://doi.org/10.1016/j.molstruc.2009.11.023
Sengupta SK, Pandey OP, Srivastava BK, Sharma VK (1998) Synthesis, structural and biochemical aspects of titanocene and zirconocene chelates of acetylferrocenyl thiosemicarbazones. Transit Met Chem 23(4):349–353. https://doi.org/10.1023/A:1006986131435
Sheta SM, Abd-Elzaher MM, El-Sheikh SM (2021) A novel nano-lanthanum complex: synthesis, characterization and application as a macrofuran chemosensor in pharmaceutical, biological and environmental samples. RSC Adv 11(16):9675–9681. https://doi.org/10.1039/D0RA10116H
Sheta D, El-Sheikh SM, Abd-Elzaher MM, Wassel AR (2019a) A novel nano-size lanthanum metal–organic framework based on 5-amino-isophthalic acid and phenylenediamine: Photoluminescence study and sensing applications. Appl Organom Chem 33(4):e4777. https://doi.org/10.1002/aoc.4777
Sheng Y, Hou Z, Cui S, Cao K, Yuan S, Sun M, Huang JKG, Turel I, Liu Y (2019) Covalent versus Noncovalent Binding of Ruthenium η6-p-Cymene Complexes to Zinc-Finger Protein NCp7. Chem A Eur J 25(55):12789–12794. https://doi.org/10.1002/chem.201902434
Sheta SM, El-Sheikh SM, Abd-Elzaher MM (2019b) A novel optical approach for determination of prolactin based on Pr-MOF nanofibers. Anal Bioanal Chem 411(7):1339–1349. https://doi.org/10.1007/s00216-018-01564-6
Sheta SM, Akl MA, Saad HE, El-Gharkawy ESR (2020) A novel cerium (III)–isatin Schiff base complex: spectrofluorometric and DFT studies and application as a kidney biomarker for ultrasensitive detection of human creatinine. RSC Adv 10(10):5853–5863. https://doi.org/10.1039/C9RA10133K
Sheldrick GM (2013) SHELXL2013 University of Göttingen. Göttingen, Germany, p 2013
Sheldrick GM (1999) SADABS. University of Göttingen, Göttingen, Germany
Sheldrick GM (2010) SADABS. University of Göttingen, Göttingen, Germany, Program for Empirical Absorption Correction of Area Detector Data
Sheldrick GM (2008) Acta Crystallogr Sect A Fundam Crystallogr 64:112
Solola LA, Zabula AV, Dorfner WL, Manor BC, Carroll PJ, Schelter EJ (2017) Cerium (IV) imido complexes: structural, computational, and reactivity studies. J Am Chem Soc 139(6):2435–2442. https://doi.org/10.1021/jacs.6b12369
Tamang AM, Singh N, Chandraker SK, Ghosh MK (2022) Solvent impregnatedresin a potential alternative material for separation dyes, metal and phenolic compounds: A review. Curr Res Green Sustain Chem. https://doi.org/10.1016/j.crgsc.2021.100232
Turan N, Gündüz B, Körkoca H, Adigüzel R, Çolak N, Buldurun K (2014) Study of structure and spectral characteristics of the Zinc (II) and Copper (II) complexes with 5, 5-Dimethyl-2-(2-(3-nitrophenyl) hydrazono) cyclohexane-1, 3-dione and their effects on optical properties and the developing of the energy band gap and investigation of antibacterial activity. J Mex Chem Soc 58(1):65–75. http://www.scielo.org.mx/scielo.php?pid=S1870249X2014000100011&script=sci_arttext&tlng=en.
Vinothkumar G, Lalitha AI, Suresh Babu K (2018) Cerium phosphate–cerium oxide heterogeneous composite Nanozymes with enhanced peroxidase-like biomimetic activity for glucose and hydrogen peroxide sensing. Inorg Chem 1:349–358. https://doi.org/10.1021/acs.inorgchem.8b02423
Wang J, Liu X, Sun Y, Yan L, He S (2011) Synthesis, crystal structures, thermal properties, and DNA-binding studies of transition metal complexes with imidazole ligands. J Coord Chem 64(9):1554–1565. https://doi.org/10.1080/00958972.2011.575937
Wolfe A, Shimer GH Jr, Meehan T (1987) Polycyclic aromatic hydrocarbons physically intercalate into duplex regions of denatured DNA. Biochem 26(20):6392–6396. https://doi.org/10.1021/bi00394a013
Yüce AO, Mert BD, Kardaş G, Yazıcı B (2014) Electrochemical and quantum chemical studies of 2-amino-4-methyl-thiazole as corrosion inhibitor for mild steel in HCl solution. Corros Sci 83:310–316. https://doi.org/10.1016/j.corsci.2014.02.029
Zhan CG, Nichols JA, Dixon DA (2003) Ionization potential, electron affinity, electronegativity, hardness, and electron excitation energy: molecular properties from density functional theory orbital energies. J Phys Chem A 107(20):4184–4195. https://doi.org/10.1021/jp0225774
Zhang G, Hu X, Pan J (2011) Spectroscopic studies of the interaction between pirimicarb and calf thymus DNA. Spectrochim Acta A Mol Biomol Spectrosc 78(2):687–694. https://doi.org/10.1016/j.saa.2010.11.050
Acknowledgements
The authors are thankful to the Madhya Pradesh Council of Science & Technology, Govt. of India, MP (File No. A/R&D/RP-2/ Phy&Engg./2017-18/271), and DST-FIST, Govt. of India (File No. SR/FST/CS-I/2017/2(C)), for financial assistance to the development of the Instrumental facility at Department of Chemistry, Indira Gandhi National Tribal University, Amarkantak, MP, India. Authors are also thankful to IISER Pune and GGU (Central University), Chhattisgarh, India, for measurement of single X-ray crystallography, CHN, and FTIR analysis.
Accession Codes: CCDC 1951600 contains the supplementary crystallographic data for TBA3[Ce(NO3)6]. This data can be free of charge via http://www.ccdc.cam.ac.uk/conts/retrieving.html or from the Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge, CB2, 1EZ, UK; fax(+ 44) 1223-336-033; or e-mail:deposit@ccdc.cam.ac.uk. Electronic supplementary information (ESI) available: ESI* S 1-7 and Tables 1-3.
Funding
This work was fully supported by Madhya Pradesh Council of Science & Technology, Govt. of India, Madhya Pradesh (File No. A/R&D/RP-2/ Phy&Engg./2017–18/271), and Indira Gandhi National Tribal University, Amarkantak, Madhya Pradesh, India.
Author information
Authors and Affiliations
Contributions
The metal complex was synthesized by Dr. M.K. Ghosh. The applications of the complexes were investigated by Dr. M.K. Ghosh and Dr. S.K. Chandraker. The DFT was performed by C. Das and Dr. S. Sikdar. All the experiments were designed and supervised by Prof. T.K. Ghorai. The manuscript was written and reviewed by Dr. M.K. Ghosh and Prof. T.K. Ghorai.
Corresponding author
Ethics declarations
Conflict of interest
The authors declare no conflict of financial interest.
Additional information
Publisher's Note
Springer Nature remains neutral with regard to jurisdictional claims in published maps and institutional affiliations.
Supplementary Information
Below is the link to the electronic supplementary material.
11696_2022_2091_MOESM1_ESM.docx
The Electronic Supporting Information is available on the Springer Publications website at DOI: https://doi.org/10.1007/s11696-022-02091-6. FTIR, Electronic spectra, Optical data, DFT, and X-ray crystallographic data.
Rights and permissions
About this article
Cite this article
Ghosh, M.K., Chandraker, S.K., Sikdar, S. et al. Molecular recognition, characterization and biological importance of tetrabutylammonium hexanitrate cerium (III) complex. Chem. Pap. 76, 3259–3273 (2022). https://doi.org/10.1007/s11696-022-02091-6
Received:
Accepted:
Published:
Issue Date:
DOI: https://doi.org/10.1007/s11696-022-02091-6