Geometry & MOs

Info

ID:	211014
PubChem CID:	80883807
Reduced:	FN3O3H8C13 (1)
Stoich.:	AB3C3D8E13 (1)
Weight, g/mol:	243.08079
ΔH_f, kcal/mol:	-6.18
Dipole, Da:	8.49
IP(EA), eV:	-9.58(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-[6-(methylamino)pyridin-2-yl]oxybenzonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1OC2=CC(=CC(=C2)[N+](=O)[O-])N)F)C#N

DOS

IR

Vibrations