Geometry & MOs

Info

ID:	143535
PubChem CID:	53223585
Reduced:	FNCl2O2H6C12 (1)
Stoich.:	ABC2D2E6F12 (1)
Weight, g/mol:	249.078979
ΔH_f, kcal/mol:	-85.27
Dipole, Da:	2.67
IP(EA), eV:	-10.25(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-naphthalen-1-ylpyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1F)Cl)C2=CN=C(C=C2C(=O)O)Cl

DOS

IR

Vibrations