Geometry & MOs

Info

ID:	374836
PubChem CID:	131349475
Reduced:	SF2O3H8C10 (1)
Stoich.:	AB2C3D8E10 (1)
Weight, g/mol:	242.021307
ΔH_f, kcal/mol:	-197.72
Dipole, Da:	1.75
IP(EA), eV:	-8.78(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(difluoromethoxy)-4-methyl-1-benzothiophene-7-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1CO)C=C(S2)OC(F)F)O

DOS

IR

Vibrations