Geometry & MOs

Info

ID:	333469
PubChem CID:	127252021
Reduced:	ON3C23H25 (1)
Stoich.:	AB3C23D25 (1)
Weight, g/mol:	347.179776
ΔH_f, kcal/mol:	41.26
Dipole, Da:	1.65
IP(EA), eV:	-8.82(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=NC=C(C=C2)C3CCCCN3CC4=CN=CC=C4

DOS

IR

Vibrations