Geometry & MOs

Info

ID:	200435
PubChem CID:	79388821
Reduced:	ClON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	248.163711
ΔH_f, kcal/mol:	-6.06
Dipole, Da:	7.6
IP(EA), eV:	-9.3(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(dimethylamino)pyridin-3-yl]-2-methylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1C(CCN1)C(=O)NC2=CC(=C(C=C2)Cl)C#N

DOS

IR

Vibrations