Geometry & MOs

Info

ID:	267577
PubChem CID:	103582749
Reduced:	BrClN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	288.99814
ΔH_f, kcal/mol:	18.64
Dipole, Da:	3.46
IP(EA), eV:	-8.43(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

C1CC(NC1)C2CCCN2C3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations