Geometry & MOs

Info

ID:	267469
PubChem CID:	103582334
Reduced:	BrClN4C10H14 (1)
Stoich.:	ABC4D10E14 (1)
Weight, g/mol:	318.02469
ΔH_f, kcal/mol:	41.13
Dipole, Da:	3.81
IP(EA), eV:	-9.04(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-3-chloropyridin-2-yl)-propan-2-ylamino]propanimidamide

Drug info:

PubChemData

Smile

CC(CN(C)C1=C(C=C(C=N1)Br)Cl)C(=N)N

DOS

IR

Vibrations