Geometry & MOs

Info

ID:	374835
PubChem CID:	131349474
Reduced:	SF2O3H8C10 (1)
Stoich.:	AB2C3D8E10 (1)
Weight, g/mol:	246.016222
ΔH_f, kcal/mol:	-198.65
Dipole, Da:	2.81
IP(EA), eV:	-8.79(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethoxy)-4-(hydroxymethyl)-1-benzothiophen-7-ol

Drug info:

PubChemData

Smile

C1=C(C=C(C2=C1C=C(S2)OC(F)F)O)CO

DOS

IR

Vibrations