Geometry & MOs

Info

ID:	36586
PubChem CID:	8009228
Reduced:	NO4C18H19 (1)
Stoich.:	AB4C18D19 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-129.16
Dipole, Da:	7.57
IP(EA), eV:	-8.99(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-3-ethyl-5-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-6-phenyl-1,6-dihydropyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations