1-Formyl-3-phenyl-5-(4-isopropylphenyl)-2-pyrazoline: Synthesis, characterization, antimicrobial activity and DFT studies

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dc.contributor.authorSid, Assia
dc.contributor.authorMessai, Amel
dc.contributor.authorParlak, Cemal
dc.contributor.authorKazanci, Nadide
dc.contributor.authorLuneau, Dominique
dc.contributor.authorKesan, Gurkan
dc.contributor.authorRhyman, Lydia
dc.contributor.authorAlswaidan, Ibrahim A.
dc.contributor.authorRamasami, Ponnadurai
dc.date.accessioned2019-10-27T11:25:22Z
dc.date.available2019-10-27T11:25:22Z
dc.date.issued2016
dc.departmentEge Üniversitesien_US
dc.description.abstractThe structure of 1-formy1-3-phenyl-5-(4-isopropylpheny1)-2-pyrazoline synthesized as single crystal was investigated by FTIR, NMR, XRD. Experimental data were complemented by quantum mechanical calculations. XRD data show that the compound crystallizes in the triclinic system (P-1) via trans isomer (a = 6.4267(4) angstrom, b = 10.9259(12) angstrom, c = 12.4628(9) angstrom and alpha = 102.894(8)degrees, beta = 102.535(6)degrees, gamma = 101.633(7)degrees). Anti-microbial screening results indicate that the compound shows promising activity. The theoretically predicted and experimentally obtained parameters reveal further insight into pyrazoline systems. (C) 2016 Elsevier B.V. All rights reserved.en_US
dc.description.sponsorshipTassili Programme [15MDU940]; Deanship of Scientific Research at King Saud UniversityScience and Technology Development Fund (STDF) [RGP VPP-207]en_US
dc.description.sponsorshipAM and DL acknowledge the Tassili Programme No 15MDU940 for the financial support. The authors are thankful to reviewers for their useful comments to improve the manuscript. The authors extend their appreciation to the Deanship of Scientific Research at King Saud University for the research group Project No. RGP VPP-207.en_US
dc.identifier.doi10.1016/j.molstruc.2016.05.043
dc.identifier.endpage53en_US
dc.identifier.issn0022-2860
dc.identifier.issn1872-8014
dc.identifier.issn0022-2860en_US
dc.identifier.issn1872-8014en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.startpage46en_US
dc.identifier.urihttps://doi.org/10.1016/j.molstruc.2016.05.043
dc.identifier.urihttps://hdl.handle.net/11454/33381
dc.identifier.volume1121en_US
dc.identifier.wosWOS:000379094100006en_US
dc.identifier.wosqualityQ3en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.language.isoenen_US
dc.publisherElsevier Science Bven_US
dc.relation.ispartofJournal of Molecular Structureen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectPyrazolinesen_US
dc.subjectCrystal structureen_US
dc.subjectHydrogen-bondingen_US
dc.subjectAntimicrobial activityen_US
dc.title1-Formyl-3-phenyl-5-(4-isopropylphenyl)-2-pyrazoline: Synthesis, characterization, antimicrobial activity and DFT studiesen_US
dc.typeArticleen_US

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