Geometry & MOs

Info

ID:	442832
PubChem CID:	135256506
Reduced:	ISH4F5C13 (1)
Stoich.:	ABC4D5E13 (1)
Weight, g/mol:	363.90305
ΔH_f, kcal/mol:	-183.39
Dipole, Da:	4.4
IP(EA), eV:	-9.06(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,6-trifluoro-7-iododibenzothiophene

Drug info:

PubChemData

Smile

C1=CC(=C(C2=C1C3=C(S2)C(=C(C=C3)I)F)F)C(F)(F)F

DOS

IR

Vibrations