Geometry & MOs

Info

ID:	251252
PubChem CID:	103102476
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	17.11
Dipole, Da:	8.29
IP(EA), eV:	-9.4(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-2-oxoethyl)-ethylamino]-N-(4-cyanophenyl)propanamide

Drug info:

PubChemData

Smile

CCN(CC1=CC(=NC=C1)C#N)CC(=O)N

DOS

IR

Vibrations