Geometry & MOs

Info

ID:	161206
PubChem CID:	57391035
Reduced:	ClFNO3C22H29 (1)
Stoich.:	ABCD3E22F29 (1)
Weight, g/mol:	373.205322
ΔH_f, kcal/mol:	-186.81
Dipole, Da:	5.25
IP(EA), eV:	-8.82(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(diethylamino)-2-hydroxypropoxy]phenyl]-3-(4-fluorophenyl)propan-1-one

Drug info:

PubChemData

Smile

CCN(CC)CC(COC1=CC=CC=C1C(=O)CCC2=CC=C(C=C2)F)O.Cl

DOS

IR

Vibrations