Geometry & MOs

Info

ID:	133466
PubChem CID:	51530976
Reduced:	ClSO2N3C16H20 (1)
Stoich.:	ABC2D3E16F20 (1)
Weight, g/mol:	343.135448
ΔH_f, kcal/mol:	-39.27
Dipole, Da:	4.61
IP(EA), eV:	-8.3(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-[2-(N-ethyl-3-methylanilino)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCN(CCNS(=O)(=O)C1=CN=C(C=C1)Cl)C2=CC=CC(=C2)C

DOS

IR

Vibrations