Geometry & MOs

Info

ID:	374454
PubChem CID:	131329772
Reduced:	BrSF3H6C10 (1)
Stoich.:	ABC3D6E10 (1)
Weight, g/mol:	293.93257
ΔH_f, kcal/mol:	-110.86
Dipole, Da:	2.49
IP(EA), eV:	-9.15(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(bromomethyl)-4-(difluoromethyl)-3-fluoro-1-benzothiophene

Drug info:

PubChemData

Smile

C1=CC2=C(C(=CS2)C(F)F)C(=C1F)CBr

DOS

IR

Vibrations