Geometry & MOs

Info

ID:	195625
PubChem CID:	78712849
Reduced:	N3O5C21H25 (1)
Stoich.:	A3B5C21D25 (1)
Weight, g/mol:	390.157957
ΔH_f, kcal/mol:	-179.75
Dipole, Da:	3.74
IP(EA), eV:	-9.51(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] 2-(4-cyanophenoxy)propanoate

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)OCC(=O)NC(C)C4CC4

DOS

IR

Vibrations