Geometry & MOs

Info

ID:	442474
PubChem CID:	135252323
Reduced:	N3C19H23 (1)
Stoich.:	A3B19C23 (1)
Weight, g/mol:	242.105528
ΔH_f, kcal/mol:	52.41
Dipole, Da:	4.11
IP(EA), eV:	-9.57(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-methyl-6-(4-methylpyridin-2-yl)pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NC=C1)C2=CC(=CC(=N2)C#N)C(C)(C)C

DOS

IR

Vibrations