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AuthorWarad, Ismail
AuthorAl-Nuri, Mohammed
AuthorAli, Oraib
AuthorAbu-Reidah, Ibrahim M.
AuthorBarakat, Assem
AuthorBen Hadda, Taibi
AuthorZarrouk, Abdelkader
AuthorRadi, Smaail
AuthorTouzani, Rachid
AuthorElmsellem, Hicham
Available date2020-05-14T09:55:44Z
Publication Date2019
Publication NameIranian Journal of Chemistry and Chemical Engineering
ResourceScopus
ISSN10219986
URIhttp://hdl.handle.net/10576/14835
AbstractTwo new hexahydropyrimidine compounds were prepared in high yield by condensation of an equimolar amount of 1,3-diamine with 2-dipyridylketone at room temperature in dichloromethane. The desired hexahydropyrimidine structures were confirmed on the basis of their UV-Visible, elemental analysis, FT-IR,1H-NMR, TG/DTG and EI-MS data. Hirschfield and DFT/B3LYP theoretical analyses were performed and their output results were compared to experimental data. - 2019, Iranian Institute of Research and Development in Chemical Industries. All rights reserved.
SponsorThe authors extend their appreciation to the Deanship of Scientific Research at King Saud University for funding the work through the research group project Number (RGP-257-1435-1436).
Languageen
PublisherIranian Institute of Research and Development in Chemical Industries
SubjectDFT
Hexahydropyrimidine
Hirschfield surface
NMR
TitleSynthesis, physico-chemical, hirschfield surface and DFT/B3LYP calculation of two new hexahydropyrimidine heterocyclic compounds
TypeArticle
Pagination59-68
Issue Number4
Volume Number38
dc.accessType Open Access


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