Geometry & MOs

Info

ID:	354635
PubChem CID:	127287252
Reduced:	ON4C22H30 (1)
Stoich.:	AB4C22D30 (1)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	8.25
Dipole, Da:	5.11
IP(EA), eV:	-8.36(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(naphthalen-2-ylmethyl)-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C3=CCN(CC3)C(=O)NCC(C)N(C)C4CC4

DOS

IR

Vibrations