Geometry & MOs

Info

ID:	258758
PubChem CID:	103156813
Reduced:	N3O3C12H25 (1)
Stoich.:	A3B3C12D25 (1)
Weight, g/mol:	198.136828
ΔH_f, kcal/mol:	-143.29
Dipole, Da:	3.98
IP(EA), eV:	-8.78(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxybutan-1-one

Drug info:

PubChemData

Smile

CCN1CCOC(C1)CNC(=O)CC(CN)OC

DOS

IR

Vibrations