Geometry & MOs

Info

ID:	351018
PubChem CID:	127279455
Reduced:	ClO2N3C19H24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	390.226705
ΔH_f, kcal/mol:	-86.17
Dipole, Da:	5.21
IP(EA), eV:	-8.51(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

C1CC(C1)C2CCCN2C(=O)NC3=C(C=CC(=C3)N4CCCC4=O)Cl

DOS

IR

Vibrations