Geometry & MOs

Info

ID:	55610
PubChem CID:	17395657
Reduced:	FN2O4C17H19 (1)
Stoich.:	AB2C4D17E19 (1)
Weight, g/mol:	353.210327
ΔH_f, kcal/mol:	-159.05
Dipole, Da:	6.25
IP(EA), eV:	-8.41(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-methylphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1CNC(=O)NC2=CC=C(C=C2)F)OC)OC

DOS

IR

Vibrations