Geometry & MOs

Info

ID:	372055
PubChem CID:	131292687
Reduced:	NOH4C5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	240.025643
ΔH_f, kcal/mol:	-4.46
Dipole, Da:	3.56
IP(EA), eV:	-9.3(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-fluoro-4-methyl-1-benzothiophen-7-yl)-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

CC(C#N)C1=NC2=C(O1)C=CC(=C2)O

DOS

IR

Vibrations