Geometry & MOs

Info

ID:	16064
PubChem CID:	458875
Reduced:	SN2O3C10H16 (1)
Stoich.:	AB2C3D10E16 (1)
Weight, g/mol:	244.088164
ΔH_f, kcal/mol:	-109.83
Dipole, Da:	5.4
IP(EA), eV:	-8.42(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations