Geometry & MOs

Info

ID:	333412
PubChem CID:	127251964
Reduced:	FON2H23C24 (1)
Stoich.:	ABC2D23E24 (1)
Weight, g/mol:	361.195426
ΔH_f, kcal/mol:	-20.16
Dipole, Da:	4.64
IP(EA), eV:	-9.42(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations