Geometry & MOs

Info

ID:	373339
PubChem CID:	131313443
Reduced:	SO4H10C11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	238.02998
ΔH_f, kcal/mol:	-131.97
Dipole, Da:	7.88
IP(EA), eV:	-8.65(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxy-7-methoxy-1-benzothiophen-2-yl)acetic acid

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)SC(=C2)CC(=O)O)O

DOS

IR

Vibrations