Geometry & MOs

Info

ID:	212386
PubChem CID:	81060340
Reduced:	N3C16H17 (1)
Stoich.:	A3B16C17 (1)
Weight, g/mol:	244.168797
ΔH_f, kcal/mol:	53.28
Dipole, Da:	4.49
IP(EA), eV:	-8.97(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(1-methylpiperidin-4-yl)amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations