Publication:
Synthesis, Spectroscopic (FT-IR, UV–Vis), Experimental (X-Ray) and Theoretical (HF/DFT) Study of: (E)-2-Chloro-N-((4-nitrocyclopenta-1,3-dienyl)methylene)Benzenamine

Simple item page
dc.authorscopusid36951989800
dc.authorscopusid36163030300
dc.authorscopusid57188717345
dc.authorscopusid7003281189
dc.authorscopusid36039473500
dc.contributor.authorÖzdemir Tarı, G.
dc.contributor.authorCeylan, Ü.
dc.contributor.authorUzun, S.
dc.contributor.authorAģar, E.
dc.contributor.authorBüyuk̈güngör, O.
dc.date.accessioned2020-06-21T13:05:39Z
dc.date.available2020-06-21T13:05:39Z
dc.date.issued2018
dc.departmentOndokuz Mayıs Üniversitesien_US
dc.department-temp[Özdemir Tarı] Gonca, Vezirköprü Vocational School, Ondokuz Mayis Üniversitesi, Samsun, Turkey; [Ceylan] Ümit, Department of Medical Services and Techniques, Giresun Üniversitesi, Giresun, Giresun, Turkey; [Uzun] Serap, Department of Electrical and Electronic Engineering, Giresun Üniversitesi, Giresun, Giresun, Turkey; [Aģar] Erbil, Ondokuz Mayis University Faculty of Science and Arts, Samsun, Turkey; [Büyuk̈güngör] Orhan, Department of Physics, Ondokuz Mayis University Faculty of Science and Arts, Samsun, Turkeyen_US
dc.description.abstractA new Schiff base, (E)-2-chloro-N-((4-nitrocyclopenta-1,3-dienyl)methylene)benzenamine, C<inf>11</inf>H<inf>7</inf>ClN<inf>2</inf>O<inf>2</inf>S has been synthesized and structurally characterized by spectroscopy methods. The computational calculations were done at HF and DFT/B3LYP/B3PW91 and PBEPBE levels with 6–311++G(d,p) basis set. The FT-IR and UV–Vis spectra have been calculated theoretically using the same methods and are compared with the experimental spectra. These comparisons indicated that the calculated results are in agreement with the experimental data. In addition, electronic and optical properties of the title compound are investigated based on theoretical calculations. © 2018 Elsevier B.V.en_US
dc.identifier.doi10.1016/j.molstruc.2018.04.005
dc.identifier.endpage24en_US
dc.identifier.issn0022-2860
dc.identifier.scopus2-s2.0-85054697449
dc.identifier.scopusqualityQ1
dc.identifier.startpage18en_US
dc.identifier.urihttps://doi.org/10.1016/j.molstruc.2018.04.005
dc.identifier.volume1174en_US
dc.identifier.wosWOS:000449132500005
dc.identifier.wosqualityQ2
dc.language.isoenen_US
dc.publisherElsevier B.V.en_US
dc.relation.ispartofJournal of Molecular Structureen_US
dc.relation.journalJournal of Molecular Structureen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectFT-IR and UV–Vis Spectral Analysisen_US
dc.subjectSchiff Baseen_US
dc.subjectX-Ray Diffractionen_US
dc.titleSynthesis, Spectroscopic (FT-IR, UV–Vis), Experimental (X-Ray) and Theoretical (HF/DFT) Study of: (E)-2-Chloro-N-((4-nitrocyclopenta-1,3-dienyl)methylene)Benzenamineen_US
dc.typeArticleen_US
dspace.entity.typePublication

Files

Collections

Scopus İndeksli Yayınlar Koleksiyonu
WoS İndeksli Yayınlar Koleksiyonu