Geometry & MOs

Info

ID:	171352
PubChem CID:	75365786
Reduced:	FN3H8C12 (1)
Stoich.:	AB3C8D12 (1)
Weight, g/mol:	230.080376
ΔH_f, kcal/mol:	50.86
Dipole, Da:	4.95
IP(EA), eV:	-9.18(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(methylamino)pyrimidin-4-yl]pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=CN2C(=CN=C2N=C1)C3=CC=C(C=C3)F

DOS

IR

Vibrations