Geometry & MOs

Info

ID:	436140
PubChem CID:	135194066
Reduced:	FON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	310.148141
ΔH_f, kcal/mol:	-45.55
Dipole, Da:	2.91
IP(EA), eV:	-7.92(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(3-fluoro-4-methoxyphenyl)piperidin-1-yl]benzonitrile

Drug info:

PubChemData

Smile

C1CN(CCC1OC2=CC=C(C=C2)F)C3=CC=C(C=C3)N

DOS

IR

Vibrations