Geometry & MOs

Info

ID:	162157
PubChem CID:	57393790
Reduced:	ClFN2O3C23H30 (1)
Stoich.:	ABC2D3E23F30 (1)
Weight, g/mol:	387.184586
ΔH_f, kcal/mol:	-171.27
Dipole, Da:	5.74
IP(EA), eV:	-8.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluorophenyl)-1-[2-(2-hydroxy-3-morpholin-4-ylpropoxy)phenyl]propan-1-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(COC2=CC=CC=C2C(=O)CCC3=CC=C(C=C3)F)O.Cl

DOS

IR

Vibrations