Isopropyl 3-Carbamoyl-4-(3-Chlorophenyl)-6-Methyl-2-Oxo-1,2,3,4-Tetrahydro-5-Pyrimidinecarboxylate

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Properties Simple | Detailed

Formula C16H18ClN3O4
IUPAC Name isopropyl (4r)-3-carbamoyl-4-(3-chlorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate
Molecular Mass 351.785 g·mol−1
Heat of Formation -709.4 ± 16.7 kJ·mol−1
Dipole Moment 5.87 ± 1.08 D
Volume 404.4 Å 3
Surface Area 330.75 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry C1
InChIKey NEORKLPGSMVSDS-CYBMUJFWSA-N
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Elements H C N O Cl