Geometry & MOs

Info

ID:	268271
PubChem CID:	103598670
Reduced:	O2N4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	53.05
Dipole, Da:	1.09
IP(EA), eV:	-9.05(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxyphenyl)-N-[2-methyl-3-(propylsulfonylamino)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2=CC(=CC=C2)NC(=O)C=CC3=CC=NC=C3

DOS

IR

Vibrations