Geometry & MOs

Info

ID:	285730
PubChem CID:	104122638
Reduced:	ClON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	309.124405
ΔH_f, kcal/mol:	-15.24
Dipole, Da:	5.34
IP(EA), eV:	-9.31(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-chloro-6-methylpyridine-4-carbonyl)piperidin-4-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)N(C)C(=O)C2=CC(=NC(=C2)C)Cl

DOS

IR

Vibrations