Geometry & MOs

Info

ID:	69540
PubChem CID:	47193718
Reduced:	ClON2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	295.108754
ΔH_f, kcal/mol:	-9.89
Dipole, Da:	1.67
IP(EA), eV:	-8.7(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-methylphenyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NC(C2CC2)C3CC3)Cl

DOS

IR

Vibrations