Geometry & MOs

Info

ID:	211621
PubChem CID:	81044566
Reduced:	ClON2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	248.163711
ΔH_f, kcal/mol:	-62.24
Dipole, Da:	3.96
IP(EA), eV:	-8.97(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(cyanomethyl)-3-piperidin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations