Geometry & MOs

Info

ID:	374293
PubChem CID:	131326319
Reduced:	SF2O2H8C11 (1)
Stoich.:	AB2C2D8E11 (1)
Weight, g/mol:	242.021307
ΔH_f, kcal/mol:	-156.93
Dipole, Da:	4.02
IP(EA), eV:	-9.36(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethyl)-6-methyl-1-benzothiophene-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C(=O)O)C=C(S2)C(F)F

DOS

IR

Vibrations