Geometry & MOs

Info

ID:	212524
PubChem CID:	81060838
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	260.163711
ΔH_f, kcal/mol:	-13.28
Dipole, Da:	6.04
IP(EA), eV:	-8.73(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-cyano-2,6-dimethylpyridin-4-yl)-methylamino]-N-propylacetamide

Drug info:

PubChemData

Smile

CCN(CC1CCCO1)C2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations