Geometry & MOs

Info

ID:	158672
PubChem CID:	56464624
Reduced:	SN4O4C19H20 (1)
Stoich.:	AB4C4D19E20 (1)
Weight, g/mol:	494.162391
ΔH_f, kcal/mol:	-97.86
Dipole, Da:	7.45
IP(EA), eV:	-8.85(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-4-[[(4-acetamidophenyl)sulfonylamino]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

DOS

IR

Vibrations