Geometry & MOs

Info

ID:	375195
PubChem CID:	131472827
Reduced:	BrSO3H7C10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	285.92993
ΔH_f, kcal/mol:	-91.85
Dipole, Da:	4.07
IP(EA), eV:	-9.13(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-2-hydroxy-1-benzothiophen-6-yl)acetic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations