Geometry & MOs

Info

ID:	333420
PubChem CID:	127251972
Reduced:	NC8H9 (3)
Stoich.:	AB8C9 (3)
Weight, g/mol:	361.195426
ΔH_f, kcal/mol:	65.13
Dipole, Da:	2.33
IP(EA), eV:	-8.99(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-fluorophenyl)methyl]-5-[1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC2=NC=C(C=C2)C3CCCCN3CC4=CC=CC=N4

DOS

IR

Vibrations