Geometry & MOs

Info

ID:	158465
PubChem CID:	56463708
Reduced:	SO3N4C26H30 (1)
Stoich.:	AB3C4D26E30 (1)
Weight, g/mol:	444.219512
ΔH_f, kcal/mol:	-41.47
Dipole, Da:	4.12
IP(EA), eV:	-8.42(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(ethylsulfamoyl)-2-methyl-N-[2-(4-methylpiperazin-1-yl)-1-phenylethyl]benzamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

DOS

IR

Vibrations