Geometry & MOs

Info

ID:	375179
PubChem CID:	131472780
Reduced:	BrSO3H7C10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	285.92993
ΔH_f, kcal/mol:	-87.9
Dipole, Da:	6.19
IP(EA), eV:	-9.1(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CSC2=C1C(=C(C=C2CC(=O)O)Br)O

DOS

IR

Vibrations