Geometry & MOs

Info

ID:	212235
PubChem CID:	81059898
Reduced:	ON3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	49.72
Dipole, Da:	6.17
IP(EA), eV:	-9.99(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyano-2,6-dimethylpyridin-4-yl)-6-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC2=C(C(=NC(=C2)C)C)C#N)C)C#N

DOS

IR

Vibrations