Geometry & MOs

Info

ID:	77424
PubChem CID:	48430124
Reduced:	SN2O5C17H20 (1)
Stoich.:	AB2C5D17E20 (1)
Weight, g/mol:	392.140593
ΔH_f, kcal/mol:	-166.0
Dipole, Da:	7.22
IP(EA), eV:	-8.43(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dimethoxyphenyl)-N-[3-(methanesulfonamido)-4-methylphenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)OC)OC)NS(=O)(=O)C

DOS

IR

Vibrations