Geometry & MOs

Info

ID:	374774
PubChem CID:	131342704
Reduced:	FSO3H9C11 (1)
Stoich.:	ABC3D9E11 (1)
Weight, g/mol:	240.025643
ΔH_f, kcal/mol:	-139.44
Dipole, Da:	2.26
IP(EA), eV:	-8.85(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-fluoro-3-hydroxy-1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(S1)C=CC(=C2O)F

DOS

IR

Vibrations