Geometry & MOs

Info

ID:	296157
PubChem CID:	117558443
Reduced:	ON4H10C13 (1)
Stoich.:	AB4C10D13 (1)
Weight, g/mol:	251.105862
ΔH_f, kcal/mol:	59.74
Dipole, Da:	3.3
IP(EA), eV:	-10.02(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-(3,5-dimethylphenyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CNC(=O)C2=NC=CC(=C2)C#N

DOS

IR

Vibrations