Geometry & MOs

Info

ID:	174487
PubChem CID:	75771968
Reduced:	FON3C20H20 (1)
Stoich.:	ABC3D20E20 (1)
Weight, g/mol:	357.16079
ΔH_f, kcal/mol:	-23.96
Dipole, Da:	6.19
IP(EA), eV:	-8.36(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[3-(2-pyridin-3-ylpiperidin-1-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CCN1C=C(C2=C1C=C(C=C2)F)C3CCCN3C(=O)C4=CC=CC=N4

DOS

IR

Vibrations