Geometry & MOs

Info

ID:	259711
PubChem CID:	103172786
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-81.28
Dipole, Da:	5.88
IP(EA), eV:	-8.75(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3,4-dimethoxypyridin-2-yl)methyl-(2-methoxyethyl)amino]propanenitrile

Drug info:

PubChemData

Smile

CC(=C)COCCNCC1=NC=CC(=C1OC)OC

DOS

IR

Vibrations