Geometry & MOs

Info

ID:	124852
PubChem CID:	50899558
Reduced:	BrN2C15H17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	406.156039
ΔH_f, kcal/mol:	12.43
Dipole, Da:	3.77
IP(EA), eV:	-9.03(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-N-[(2-piperidin-1-ylpyridin-3-yl)methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=NC(C1=CC=CC=C1)C2=CC=CC=C2)N.Br

DOS

IR

Vibrations