Geometry & MOs

Info

ID:	374497
PubChem CID:	131330528
Reduced:	ClSO2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	242.016829
ΔH_f, kcal/mol:	-62.01
Dipole, Da:	4.26
IP(EA), eV:	-8.52(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-7-ethoxy-1-benzothiophen-6-yl)methanol

Drug info:

PubChemData

Smile

CCOC1=C(C2=C(C=C1)SC(=C2)CO)Cl

DOS

IR

Vibrations