Geometry & MOs

Info

ID:	195787
PubChem CID:	78732379
Reduced:	O2N4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	338.108899
ΔH_f, kcal/mol:	14.45
Dipole, Da:	8.06
IP(EA), eV:	-8.4(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylprop-2-enamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=CC(=C2)NC(=O)C=CC3=CN(N=C3)CC4=CC=CC=C4

DOS

IR

Vibrations