Geometry & MOs

Info

ID:	138683
PubChem CID:	52407696
Reduced:	OCl2N4H14C17 (1)
Stoich.:	AB2C4D14E17 (1)
Weight, g/mol:	418.131091
ΔH_f, kcal/mol:	46.5
Dipole, Da:	2.25
IP(EA), eV:	-9.58(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-4-nitrophenyl)-2-[4-[methyl(prop-2-enyl)sulfamoyl]anilino]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](C2=CC(=C(C=C2)Cl)Cl)NC(=O)CN3C=NC=N3

DOS

IR

Vibrations