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Mono azo dyes derived from 5-nitroanthranilic acid: Synthesis, absorption properties and DFT calculations

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dc.creator GOKALP, Merve
dc.creator TİLKİ, Tahir
dc.creator Kart, Sevgi Ozdemir
dc.creator Atay, Cigdem Karabacak
dc.date 2017-08-04T21:00:00Z
dc.date.accessioned 2020-10-06T12:02:35Z
dc.date.available 2020-10-06T12:02:35Z
dc.identifier f64a5658-6486-4c15-867a-826e7e8fca2c
dc.identifier 10.1016/j.molstruc.2017.03.107
dc.identifier https://avesis.sdu.edu.tr/publication/details/f64a5658-6486-4c15-867a-826e7e8fca2c/oai
dc.identifier.uri http://acikerisim.sdu.edu.tr/xmlui/handle/123456789/76381
dc.description Four new azo dyes: 2-[(3,5-diarnino-1H-pyrazol-4-Adiazenyl]-5-nitrobenzoic acid (A), 2-[(3-hydroxy-5methyl-IH-pyrazol-4-yl)diazenyl]-5-nitrobenzoic acid (B), 2-[(3,5-dimethyl-JH-pyrazol-4-yl)diazenyl]5-nitrobenzbic acid (C) and 2-[(5-amino-3-methyl-1H-pyrazol-4-yl)diazenyl]-5-nitrobenzoic acid (D) which have the same 4-nitrobenzene/azo/pyrazole skeleton and different substituted groups are synthesized in this work. The structures and spectroscopic properties of these new azo dyes are characterized by using spectroscopic methods such as FT-IR, H-1 NMR, C-13 NMR and UV-vis. Their solvatochromic properties in chloroform, acetic acid, methanol, dimethylformamide (DMF) and dimethylsulphoxide (DMSO) are studied. Moreover, molecular structures and some spectroscopic properties of azo dyes are investigated by utilizing the quantum computational chemistry method based on Density Functional Theory (DFT) employing B3LYP hybrid functional level with 6-31G(d) basis set. It is seen that experimental and theoretical results are compatible with each other. (C) 2017 Elsevier B.V. All rights reserved.
dc.language eng
dc.rights info:eu-repo/semantics/closedAccess
dc.title Mono azo dyes derived from 5-nitroanthranilic acid: Synthesis, absorption properties and DFT calculations
dc.type info:eu-repo/semantics/article


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