Geometry & MOs

Info

ID:	122193
PubChem CID:	50797662
Reduced:	SN2O2C19H22 (1)
Stoich.:	AB2C2D19E22 (1)
Weight, g/mol:	356.129156
ΔH_f, kcal/mol:	-55.54
Dipole, Da:	1.75
IP(EA), eV:	-8.59(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-N-[2-(3-methylphenyl)ethyl]-2-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2CCC(C2=O)C(=O)NCCC3=CC=CS3

DOS

IR

Vibrations