Geometry & MOs

Info

ID:	80957
PubChem CID:	49854119
Reduced:	O3N4C20H24 (1)
Stoich.:	A3B4C20D24 (1)
Weight, g/mol:	354.132805
ΔH_f, kcal/mol:	-72.23
Dipole, Da:	4.06
IP(EA), eV:	-9.05(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=O)C=C(N=C1CC(=O)NC2=CC=CC(=C2)C3CC3)N4CCOCC4

DOS

IR

Vibrations