Geometry & MOs

Info

ID:	212367
PubChem CID:	81060286
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	232.168797
ΔH_f, kcal/mol:	-12.38
Dipole, Da:	5.86
IP(EA), eV:	-8.82(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CCOCC)C1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations