Geometry & MOs

Info

ID:	15947
PubChem CID:	455915
Reduced:	FN2O2C29H41 (1)
Stoich.:	AB2C2D29E41 (1)
Weight, g/mol:	468.315207
ΔH_f, kcal/mol:	-131.63
Dipole, Da:	4.28
IP(EA), eV:	-7.93(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[3-(dibutylamino)phenyl]-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one

Drug info:

PubChemData

Smile

CCCCN(CCCC)C1=CC=CC(=C1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)O

DOS

IR

Vibrations