Geometry & MOs

Info

ID:	161207
PubChem CID:	57391036
Reduced:	FNO3C22H28 (1)
Stoich.:	ABC3D22E28 (1)
Weight, g/mol:	465.2446
ΔH_f, kcal/mol:	-144.19
Dipole, Da:	3.17
IP(EA), eV:	-8.74(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(dibutylamino)-2-hydroxypropoxy]phenyl]-3-(4-fluorophenyl)propan-1-one;hydrochloride

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations