Geometry & MOs

Info

ID:	279954
PubChem CID:	103845907
Reduced:	ClSO2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	211.048072
ΔH_f, kcal/mol:	-79.39
Dipole, Da:	4.09
IP(EA), eV:	-9.52(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,6-dihydroxybenzoyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C1=C(C=CS1)Cl)C(=O)O

DOS

IR

Vibrations