Geometry & MOs

Info

ID:	19898
PubChem CID:	574781
Reduced:	ClON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	267.11384
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	6.05
IP(EA), eV:	-8.78(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations