Geometry & MOs

Info

ID:	212273
PubChem CID:	81059970
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	218.153147
ΔH_f, kcal/mol:	-64.94
Dipole, Da:	1.48
IP(EA), eV:	-9.85(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(dimethylamino)ethylamino]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCC(CC)(C(=O)O)NC1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations