Geometry & MOs

Info

ID:	267509
PubChem CID:	103582456
Reduced:	BrCl2N2H11C13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	317.02944
ΔH_f, kcal/mol:	33.75
Dipole, Da:	1.82
IP(EA), eV:	-8.85(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(1-methylpiperidin-2-yl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Cl)NC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations