Geometry & MOs

Info

ID:	296643
PubChem CID:	117587006
Reduced:	ON3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	265.121512
ΔH_f, kcal/mol:	5.28
Dipole, Da:	6.77
IP(EA), eV:	-9.64(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyano-N-methyl-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)CN(C)C(=O)C1=CN=C(C=C1)C#N

DOS

IR

Vibrations