Geometry & MOs

Info

ID:	77421
PubChem CID:	48430111
Reduced:	N2S2O3C17H20 (1)
Stoich.:	A2B2C3D17E20 (1)
Weight, g/mol:	382.075406
ΔH_f, kcal/mol:	-96.94
Dipole, Da:	7.96
IP(EA), eV:	-8.79(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-N-[3-(methanesulfonamido)-4-methylphenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CSC3=C2CCCC3)NS(=O)(=O)C

DOS

IR

Vibrations