Geometry & MOs

Info

ID:	196329
PubChem CID:	78812194
Reduced:	N2O2H8C9 (2)
Stoich.:	A2B2C8D9 (2)
Weight, g/mol:	338.13789
ΔH_f, kcal/mol:	-97.7
Dipole, Da:	4.23
IP(EA), eV:	-9.19(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC=CC=C3C(=O)N

DOS

IR

Vibrations