Geometry & MOs

Info

ID:	333474
PubChem CID:	127252026
Reduced:	ON4C21H28 (1)
Stoich.:	AB4C21D28 (1)
Weight, g/mol:	374.179442
ΔH_f, kcal/mol:	-2.12
Dipole, Da:	2.69
IP(EA), eV:	-8.97(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[6-(2-fluorophenyl)pyridin-3-yl]piperidin-1-yl]-2-phenylethanone

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=NC=C(C=C2)C3CCCCN3C(=O)C4CCCCC4

DOS

IR

Vibrations