Geometry & MOs

Info

ID:	374159
PubChem CID:	131324641
Reduced:	ClSO2H9C11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	240.001178
ΔH_f, kcal/mol:	-37.95
Dipole, Da:	4.75
IP(EA), eV:	-8.96(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-ethoxy-1-benzothiophene-6-carbaldehyde

Drug info:

PubChemData

Smile

CCOC1=C(C=C2C=C(SC2=C1)Cl)C=O

DOS

IR

Vibrations