Geometry & MOs

Info

ID:	284636
PubChem CID:	104056416
Reduced:	ClSO2N5H8C12 (1)
Stoich.:	ABC2D5E8F12 (1)
Weight, g/mol:	329.096476
ΔH_f, kcal/mol:	53.54
Dipole, Da:	4.21
IP(EA), eV:	-10.37(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-cyano-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)C#N)NS(=O)(=O)C2=CC(=C(C=C2)C#N)Cl

DOS

IR

Vibrations