Geometry & MOs

Info

ID:	268150
PubChem CID:	103598089
Reduced:	ON3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	305.152812
ΔH_f, kcal/mol:	62.49
Dipole, Da:	5.02
IP(EA), eV:	-9.72(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-cyanophenyl)ethyl]-N-ethyl-3-pyridin-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)C#N)C(=O)C=CC2=CC=CC=N2

DOS

IR

Vibrations