Synthesis, crystal structure, and hirshfeld surface analysis of 4,4A,5,6,7,8-hexahydro-4A-methyl-2,5,7-triphenyl-2H-pyrido[4,3-d][1,3]oxazine

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dc.contributor.authorGümüş, Mustafa Kemal
dc.contributor.authorKansız, Sevgi
dc.contributor.authorTulemisova, G. B.
dc.contributor.authorDege, N.
dc.date.accessioned2025-06-19T10:02:14Z
dc.date.available2025-06-19T10:02:14Z
dc.date.issued2025
dc.departmentAÇÜ, Artvin Meslek Yüksekokulu, Laboratuvar Teknolojisi Bölümü
dc.description.abstractAbstract: Synthesis of the 2,6-diphenyldpiperidin-4-one derivative of title compound 4,4a,5,6,7,8-hexahydro-4a-methyl-2,5,7-triphenyl-2H-pyrido[4,3-d][1,3]oxazine (HMTPO) is developed using the reaction of 4-hydroxy-3-methyl-2-butanone, benzaldehyde, and ammonium acetate in ethanol as a solvent. The molecular structure of HMTPO is determined by single crystal X-ray diffraction. The chemical structure is confirmed by employing IR, 1H NMR, 13C NMR, and mass spectral data. To gain deeper insight into the bonding interactions within the compound, Hirshfeld surface analysis and two-dimensional fingerprint plots are conducted. The findings reveal that the Hirshfeld surfaces are predominantly influenced by H⋯H and C⋯H contacts, highlighting the significant role these interactions play in the compound’s overall stability and structural configuration.
dc.identifier.doi10.1134/S0022476625010184
dc.identifier.endpage213
dc.identifier.issn00224766
dc.identifier.issue1
dc.identifier.scopus2-s2.0-85218822589
dc.identifier.scopusqualityQ3
dc.identifier.startpage201
dc.identifier.urihttps://hdl.handle.net/11494/5532
dc.identifier.volume66
dc.identifier.wosWOS:001421218700010
dc.identifier.wosqualityQ4
dc.indekslendigikaynakScopus
dc.indekslendigikaynakWeb of Science
dc.institutionauthorGümüş, Mustafa Kemal
dc.language.isoen
dc.publisherPleiades Publishing
dc.relation.ispartofJournal of Structural Chemistry
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/embargoedAccess
dc.subject2
dc.subject6-diphenylpiperidin-4-one
dc.subjectCrystal structure
dc.subjectHirshfeld surface
dc.subjectNMR
dc.subjectOxazine
dc.subjectPiperidin-4-one
dc.subjectXRD
dc.titleSynthesis, crystal structure, and hirshfeld surface analysis of 4,4A,5,6,7,8-hexahydro-4A-methyl-2,5,7-triphenyl-2H-pyrido[4,3-d][1,3]oxazine
dc.typeArticle

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