Geometry & MOs

Info

ID:	267570
PubChem CID:	103582737
Reduced:	BrClN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	315.01379
ΔH_f, kcal/mol:	22.06
Dipole, Da:	2.45
IP(EA), eV:	-8.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-3-chloropyridin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine

Drug info:

PubChemData

Smile

CNCC1CCCN(C1)C2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations