Geometry & MOs

Info

ID:	372969
PubChem CID:	131307677
Reduced:	BrClSF2H6C10 (1)
Stoich.:	ABCD2E6F10 (1)
Weight, g/mol:	309.90302
ΔH_f, kcal/mol:	-75.5
Dipole, Da:	3.78
IP(EA), eV:	-9.06(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(bromomethyl)-6-chloro-2-(difluoromethyl)-1-benzothiophene

Drug info:

PubChemData

Smile

C1=CSC2=C1C(=C(C(=C2)C(F)F)Cl)CBr

DOS

IR

Vibrations