Geometry & MOs

Info

ID:	266914
PubChem CID:	103580045
Reduced:	BrClN2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	329.02944
ΔH_f, kcal/mol:	24.41
Dipole, Da:	3.02
IP(EA), eV:	-8.69(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations