Geometry & MOs

Info

ID:	267502
PubChem CID:	103582407
Reduced:	BrClN5H7C8 (1)
Stoich.:	ABC5D7E8 (1)
Weight, g/mol:	343.04509
ΔH_f, kcal/mol:	79.98
Dipole, Da:	1.88
IP(EA), eV:	-9.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=C(C=NC(=C1Cl)NCC2=NC=NN2)Br

DOS

IR

Vibrations