Synthesis, Physico-Chemical, Hirschfield Surface and DFT/B3LYP Calculation of Two New Hexahydropyrimidine Heterocyclic Compounds
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زبان مدرک
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Two 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.
کلید واژگان
HexahydropyrimidineHirschfield surface
NMR
DFT
Chemistry
Organic Chemistry
شماره نشریه
4تاریخ نشر
2019-08-011398-05-10
ناشر
Iranian Institute of Research and Development in Chemical Industries (IRDCI)-ACECRسازمان پدید آورنده
Department of Chemistry, AN-Najah National University P.O. Box 7, Nablus, PALESTINEDepartment of Chemistry, AN-Najah National University P.O. Box 7, Nablus, PALESTINE
Department of Chemistry, AN-Najah National University P.O. Box 7, Nablus, PALESTINE
Industrial Chemistry Department, Faculty of Sciences, Arab American University, P.O. Box. 240, 13 Zababdeh-Jenin, PALESTINE
Department of Chemistry, College of Science, King Saud University, P. O. Box 2455, Riyadh 11451, SAUDI ARABIA
Laboratoire Chimie Matériaux, FSO, Université Mohammed 1ER, Oujda 60000, MOROCCO
Laboratory of Materials, Nanotechnology, and Environment, Faculty of Sciences, Mohammed V University, Box 1014 Agdal, Rabat, MOROCCO
LCAE-URAC18, Faculté des Sciences d'Oujda, Université Mohammed Premier, BP 4808, 60046 Oujda, MOROCCO
LCAE-URAC18, Faculté des Sciences d'Oujda, Université Mohammed Premier, BP 4808, 60046 Oujda, MOROCCO
LCAE-URAC18, Faculté des Sciences d'Oujda, Université Mohammed Premier, BP 4808, 60046 Oujda, MOROCCO
