Geometry & MOs

Info

ID:	195293
PubChem CID:	78670282
Reduced:	N2O5C21H24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	420.184265
ΔH_f, kcal/mol:	-164.0
Dipole, Da:	3.12
IP(EA), eV:	-9.14(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C(=O)C(C)OC(=O)CNC(=O)C2=CC=CC=C2OC

DOS

IR

Vibrations