Geometry & MOs

Info

ID:	373071
PubChem CID:	131309428
Reduced:	SO4H8C10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	224.01433
ΔH_f, kcal/mol:	-142.02
Dipole, Da:	4.52
IP(EA), eV:	-8.98(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dihydroxy-1-benzothiophen-7-yl)acetic acid

Drug info:

PubChemData

Smile

C1=C2C=C(SC2=C(C=C1O)O)CC(=O)O

DOS

IR

Vibrations