Geometry & MOs

Info

ID:	145562
PubChem CID:	53545259
Reduced:	ClON4C19H23 (1)
Stoich.:	ABC4D19E23 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	2.04
Dipole, Da:	3.92
IP(EA), eV:	-9.07(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-cyanopyridin-2-yl)amino]ethyl 1-(2-methylpropanoyl)piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=NC=C(C(=N1)C(=O)NCCN2CCC3=CC=CC=C3C2)Cl

DOS

IR

Vibrations