Geometry & MOs

Info

ID:	266895
PubChem CID:	103579924
Reduced:	BrClN3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	313.99339
ΔH_f, kcal/mol:	24.45
Dipole, Da:	1.72
IP(EA), eV:	-8.5(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(3-imidazol-1-ylpropyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations