Crystal structure and Hirshfeld surface analysis of 7-ethoxy-5-methyl-2-(pyridin-3-yI)-11,12-di hydro5,11-methano[1,2,4]triazolo[1,5-c][1,3,5-Thenzoxadiazocine

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dc.authorid0000-0003-0793-6576en_US
dc.authorid0000-0002-8433-7975en_US
dc.authorid0000-0001-6373-5221en_US
dc.authorid0000-0003-0660-4721en_US
dc.contributor.authorAydemir, Ercan
dc.contributor.authorKansız, Sevgi
dc.contributor.authorGümüş, Mustafa Kemal
dc.contributor.authorGorobets, Nikolay Yu
dc.contributor.authorDege, Necmi
dc.date.accessioned2020-11-06T11:00:59Z
dc.date.available2020-11-06T11:00:59Z
dc.date.issued2018
dc.departmentAÇÜ, Eğitim Fakültesien_US
dc.description.abstractThe title compound, Ci(9)H(19)N(5)O(2), was prepared by the reaction of 3-amino-5(pyridin-3-yl)-1,2,4-triazole with acetone and 2-hydroxy-3-ethoxybenzaldehyde. It crystallizes from ethanol in a tetragonal space group, with one molecule in the asymmetric unit. The 1,2,4-triazole five-membered ring is planar (maximum deviation = 0.0028 angstrom). The pyridine and phenyl rings are also planar with maximum deviations of 0.0091 and 0.0094 angstrom, respectively. In the crystal, N-H center dot center dot center dot N hydrogen bonds link the molecules into supramolecular chains propagating along the c-axis direction. Hirshfeld surface analysis and twodimensional fingerprint plots have been used to analyse the intermolecular interactions present in the crystal.
dc.identifier.citationAydemir, E., Kansiz, S., Gumus, M. K., Gorobets, N. Y., & Dege, N. (2018). Crystal structure and Hirshfeld surface analysis of 7-ethoxy-5-methyl-2-(pyridin-3-yl)-11, 12-dihydro-5, 11-methano [1, 2, 4] triazolo [1, 5-c][1, 3, 5] benzoxadiazocine. Acta Crystallographica Section E: Crystallographic Communications, 74(3), 367-370.en_US
dc.identifier.doi10.1107/S2056989018002621
dc.identifier.endpage370en_US
dc.identifier.issue3en_US
dc.identifier.scopusqualityQ3
dc.identifier.startpage367en_US
dc.identifier.urihttps://hdl.handle.net/11494/2423
dc.identifier.volume74en_US
dc.identifier.wosqualityN/A
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.indekslendigikaynakPubMed
dc.institutionauthorGümüş, Mustafa Kemal
dc.language.isoenen_US
dc.publisherInt Union Crystallographyen_US
dc.relation.ecF.279
dc.relation.ispartofActa Crystallographica Section E: Crystallographic Communications
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectCrystal structureen_US
dc.subjectBiginelli condensationen_US
dc.subjectBenzoxadiazocineen_US
dc.subjectHirshfeld surfaces.en_US
dc.titleCrystal structure and Hirshfeld surface analysis of 7-ethoxy-5-methyl-2-(pyridin-3-yI)-11,12-di hydro5,11-methano[1,2,4]triazolo[1,5-c][1,3,5-Thenzoxadiazocineen_US
dc.typeArticle

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