Geometry & MOs

Info

ID:	13256
PubChem CID:	224459
Reduced:	ClN2O3C20H25 (1)
Stoich.:	AB2C3D20E25 (1)
Weight, g/mol:	376.15537
ΔH_f, kcal/mol:	-75.18
Dipole, Da:	1.29
IP(EA), eV:	-8.46(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-chlorophenyl)piperazin-1-yl]-3-(2-methoxyphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=CC=C3Cl)O

DOS

IR

Vibrations