Geometry & MOs

Info

ID:	153045
PubChem CID:	56312166
Reduced:	N3O4C24H31 (1)
Stoich.:	A3B4C24D31 (1)
Weight, g/mol:	383.257277
ΔH_f, kcal/mol:	-125.35
Dipole, Da:	4.47
IP(EA), eV:	-8.49(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexen-1-yl)ethyl]-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations