Geometry & MOs

Info

ID:	8196
PubChem CID:	75272
Reduced:	NF2O2H3C6 (1)
Stoich.:	AB2C2D3E6 (1)
Weight, g/mol:	159.013185
ΔH_f, kcal/mol:	-72.76
Dipole, Da:	3.31
IP(EA), eV:	-10.88(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-difluoro-5-nitrobenzene

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1F)F)[N+](=O)[O-]

DOS

IR

Vibrations