Geometry & MOs

Info

ID:	374609
PubChem CID:	131342022
Reduced:	SF2O2H8C10 (1)
Stoich.:	AB2C2D8E10 (1)
Weight, g/mol:	230.021307
ΔH_f, kcal/mol:	-160.28
Dipole, Da:	4.72
IP(EA), eV:	-8.91(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-5-methyl-1-benzothiophen-7-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1SC(=C2)O)OC(F)F

DOS

IR

Vibrations