Geometry & MOs

Info

ID:	152336
PubChem CID:	56311251
Reduced:	O2N3C26H33 (1)
Stoich.:	A2B3C26D33 (1)
Weight, g/mol:	462.299476
ΔH_f, kcal/mol:	-51.51
Dipole, Da:	4.28
IP(EA), eV:	-9.05(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-4-yl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NCC3(CCC3)C4=CC=CC=C4

DOS

IR

Vibrations