Geometry & MOs

Info

ID:	131953
PubChem CID:	51283998
Reduced:	SN2O3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	396.11775
ΔH_f, kcal/mol:	-110.92
Dipole, Da:	2.99
IP(EA), eV:	-9.37(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C(C)(C)C2=CC=CC=C2

DOS

IR

Vibrations