2020
DOI: 10.1007/s00894-020-4304-0
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Comparative cation sensing properties of a newly designed urea linked ferrocene-benzimidazole dyad: a DFT study

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Cited by 5 publications
(4 citation statements)
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“…The highest occupied molecular orbital (HOMO) and lowest uncopied molecular orbital (LUMO) are the crucial descriptors associated to the reactivity of molecules [56]. The HOMO seems to be one of the important aspects to have the ability as electrons donating in order to empty molecular orbitals with low energy of convenient molecules.…”
Section: Frontier Molecular Orbitals (Fmo) and Uv Spectral Analysismentioning
confidence: 99%
“…The highest occupied molecular orbital (HOMO) and lowest uncopied molecular orbital (LUMO) are the crucial descriptors associated to the reactivity of molecules [56]. The HOMO seems to be one of the important aspects to have the ability as electrons donating in order to empty molecular orbitals with low energy of convenient molecules.…”
Section: Frontier Molecular Orbitals (Fmo) and Uv Spectral Analysismentioning
confidence: 99%
“…34–39 Therefore, ferrocenes are considered invaluable templates as redox-moieties and in combination with a triazole-heterocyclic derivative can be expected to offer a greater surface area available for the deposition of specific analytes as well as an enhancement in the electron-transfer processes, and consequently, such compounds should stimulate the modified electrodes to behave as multiple signaling molecular selective chemo-sensors for metal cations. 4,5,29,40–48…”
Section: Introductionmentioning
confidence: 98%
“…[34][35][36][37][38][39] Therefore, ferrocenes are considered invaluable templates as redoxmoieties and in combination with a triazole-heterocyclic derivative can be expected to offer a greater surface area available for the deposition of specic analytes as well as an enhancement in the electron-transfer processes, and consequently, such compounds should stimulate the modied electrodes to behave as multiple signaling molecular selective chemo-sensors for metal cations. 4,5,29,[40][41][42][43][44][45][46][47][48] Herein, we present the synthesis and characterization of diverse ferrocenyl-containing triazole complexes. In addition, their structural and electrochemical properties are reported.…”
Section: Introductionmentioning
confidence: 99%
“…This is due to the unusual features of the ferrocene group which can modify the heterocyclic moiety with its particular chemical behavior [10][11][12] . Many ferrocenebased benzimidazole derivatives were used to obtain new heterocyclic compounds with wide applications in ionic recognition [13][14][15] , metal complexes [16] , fluorescent probes [17] and enantioselective and heterogeneous catalysts [18,19] . In addition, some biological activities of ferrocenyl benzimidazoles were reported, such as fungicidal properties [10] , growth inhibition of cancer cells [11,12] and antimalarial activity [20] .…”
Section: Introductionmentioning
confidence: 99%