Geometry & MOs

Info

ID:	372798
PubChem CID:	131304975
Reduced:	ISO2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	333.95245
ΔH_f, kcal/mol:	-29.32
Dipole, Da:	2.21
IP(EA), eV:	-8.5(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-7-iodo-5-methoxy-1-benzothiophene

Drug info:

PubChemData

Smile

CCOC1=CC2=CC(=C(C=C2S1)I)OC

DOS

IR

Vibrations