Geometry & MOs

Info

ID:	372136
PubChem CID:	131293637
Reduced:	BrClOSF2H6C10 (1)
Stoich.:	ABCDE2F6G10 (1)
Weight, g/mol:	325.89793
ΔH_f, kcal/mol:	-116.54
Dipole, Da:	2.65
IP(EA), eV:	-8.85(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(bromomethyl)-5-chloro-4-(difluoromethoxy)-1-benzothiophene

Drug info:

PubChemData

Smile

C1=C(C=C2C(=C1OC(F)F)C(=CS2)Cl)CBr

DOS

IR

Vibrations