Geometry & MOs

Info

ID:	16063
PubChem CID:	458874
Reduced:	ClSN2O3C10H17 (1)
Stoich.:	ABC2D3E10F17 (1)
Weight, g/mol:	280.064841
ΔH_f, kcal/mol:	-143.22
Dipole, Da:	2.78
IP(EA), eV:	-8.0(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-amino-N-ethylanilino)ethanesulfonic acid;hydrochloride

Drug info:

PubChemData

Smile

CCN(CCS(=O)(=O)O)C1=CC=C(C=C1)N.Cl

DOS

IR

Vibrations