Geometry & MOs

Info

ID:	373652
PubChem CID:	131318296
Reduced:	FSO2H9C11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	224.030729
ΔH_f, kcal/mol:	-75.65
Dipole, Da:	1.13
IP(EA), eV:	-8.71(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-3-fluoro-1-benzothiophene-5-carbaldehyde

Drug info:

PubChemData

Smile

CCOC1=C(C=CC2=C1C=C(S2)C=O)F

DOS

IR

Vibrations