Geometry & MOs

Info

ID:	268848
PubChem CID:	103601218
Reduced:	BrOF4H7C13 (1)
Stoich.:	ABC4D7E13 (1)
Weight, g/mol:	204.019827
ΔH_f, kcal/mol:	-162.81
Dipole, Da:	1.66
IP(EA), eV:	-9.79(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4,5-tetrafluoro-3-prop-2-ynoxybenzene

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC2=C(C(=CC(=C2F)F)F)F)Br

DOS

IR

Vibrations