Geometry & MOs

Info

ID:	21069
PubChem CID:	587090
Reduced:	FNO3H4C7 (1)
Stoich.:	ABC3D4E7 (1)
Weight, g/mol:	169.017521
ΔH_f, kcal/mol:	-51.33
Dipole, Da:	3.84
IP(EA), eV:	-10.79(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-nitrobenzaldehyde

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations