Geometry & MOs

Info

ID:	81793
PubChem CID:	49855165
Reduced:	O3N4C16H18 (1)
Stoich.:	A3B4C16D18 (1)
Weight, g/mol:	348.098918
ΔH_f, kcal/mol:	-68.68
Dipole, Da:	6.83
IP(EA), eV:	-9.39(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-(6-morpholin-4-yl-4-oxo-1H-pyrimidin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1COCCN1C2=CC(=O)N=C(N2)CC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations