Geometry & MOs

Info

ID:	197421
PubChem CID:	78965640
Reduced:	SO3N4C12H12 (1)
Stoich.:	AB3C4D12E12 (1)
Weight, g/mol:	267.104148
ΔH_f, kcal/mol:	-23.12
Dipole, Da:	1.97
IP(EA), eV:	-9.09(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-4-cyanophenyl)-3-methylbutane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)NC2=C(C=C(C=C2)C#N)N

DOS

IR

Vibrations