Publication:
Synthesis, Crystal Structure, and Non-Covalent Interactions in Ethyl 4-Hydrazinobenzoate Hydrochloride

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dc.authorscopusid55559665900
dc.authorscopusid36041080300
dc.authorscopusid6506139148
dc.authorscopusid6602882448
dc.authorscopusid57201620841
dc.authorscopusid36677658300
dc.contributor.authorRestrepo, J.
dc.contributor.authorGlidewell, C.
dc.contributor.authorCubillán, N.
dc.contributor.authorAlvarado, Y.
dc.contributor.authorDege, N.
dc.contributor.authorMorales-Toyo, M.
dc.date.accessioned2020-06-21T12:27:45Z
dc.date.available2020-06-21T12:27:45Z
dc.date.issued2019
dc.departmentOndokuz Mayıs Üniversitesien_US
dc.department-temp[Restrepo] Jelem, Laboratory of Sustainable Synthesis of New Materials, Venezuelan Institute of Scientific Research (IVIC), Miranda, Venezuela; [Glidewell] Christopher, School of Chemistry, University of St Andrews, St Andrews, Fife, United Kingdom; [Cubillán] Néstor, Programa de Química, Universidad del Atlántico, Colombia, Atlántico, Colombia; [Alvarado] Ysaías J., Laboratory of Molecular and Biomolecular Characterization, Venezuelan Institute of Scientific Research (IVIC), Miranda, Venezuela; [Dege] Necmi, Department of Physics, Ondokuz Mayis Üniversitesi, Samsun, Turkey; [Morales-Toyo] Miguel, Laboratory of Sustainable Synthesis of New Materials, Venezuelan Institute of Scientific Research (IVIC), Miranda, Venezuela, Facultad de Ciencias, Universidad Adventista Dominicana (UNAD), Dominican Republicen_US
dc.description.abstractThe compound ethyl 4-hydrazinobenzoate hydrochloride (E-4HB), C<inf>9</inf>H<inf>13</inf>N<inf>2</inf>O<inf>2</inf>Cl, has been synthesized and characterized by FT-IR, 1H and 13C NMR and X-ray diffraction. The compound crystallizes as colourless plates in the triclinic space group P-1, with Z' = 2 and cell parameters a = 5.9566 (4) Å, b = 7.4498 (6) Å, c = 23.5349 (17) Å, α = 84.323 (3), β = 84.521 (3), γ = 80.257 (3), V = 1020.95 (13) Å3. The component ions are linked by two N–H⋯N hydrogen bonds and eight N–H⋯Cl hydrogen bonds to form complex sheets in which each of the chloride ions accepts hydrogen bonds from four different cations. Calculations on the Non-Covalent Interactions (NCI) amplify the crystallographic conclusions concerning the intermolecular hydrogen bonds. © 2018en_US
dc.identifier.doi10.1016/j.molstruc.2018.09.056
dc.identifier.endpage370en_US
dc.identifier.issn0022-2860
dc.identifier.scopus2-s2.0-85056160450
dc.identifier.scopusqualityQ1
dc.identifier.startpage363en_US
dc.identifier.urihttps://doi.org/10.1016/j.molstruc.2018.09.056
dc.identifier.volume1177en_US
dc.identifier.wosWOS:000450377600043
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.subjectCrystal Structureen_US
dc.subjectHydrogen Bondingen_US
dc.subjectModelling of Non-Covalent Interactionsen_US
dc.subjectMolecular Structureen_US
dc.subjectSynthesisen_US
dc.titleSynthesis, Crystal Structure, and Non-Covalent Interactions in Ethyl 4-Hydrazinobenzoate Hydrochlorideen_US
dc.typeArticleen_US
dspace.entity.typePublication

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