Geometry & MOs

Info

ID:	374652
PubChem CID:	131342345
Reduced:	SBr2F2H6C10 (1)
Stoich.:	AB2C2D6E10 (1)
Weight, g/mol:	355.85045
ΔH_f, kcal/mol:	-64.74
Dipole, Da:	1.28
IP(EA), eV:	-9.01(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-(bromomethyl)-2-(difluoromethyl)-1-benzothiophene

Drug info:

PubChemData

Smile

C1=C(C=C(C2=C1C(=CS2)CBr)C(F)F)Br

DOS

IR

Vibrations