Geometry & MOs

Info

ID:	354181
PubChem CID:	127286145
Reduced:	O3N6C20H24 (1)
Stoich.:	A3B6C20D24 (1)
Weight, g/mol:	360.216141
ΔH_f, kcal/mol:	-66.0
Dipole, Da:	8.85
IP(EA), eV:	-8.18(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-morpholin-4-ylbutan-2-yl)-3-[3-(2-oxopyrrolidin-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)N3CCN(CC3)C4=NC=CC(=N4)OC

DOS

IR

Vibrations