Geometry & MOs

Info

ID:	267576
PubChem CID:	103582745
Reduced:	BrClN3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	329.02944
ΔH_f, kcal/mol:	20.23
Dipole, Da:	0.36
IP(EA), eV:	-8.86(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN)C2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations