Geometry & MOs

Info

ID:	267614
PubChem CID:	103582992
Reduced:	BrClN4H10C14 (1)
Stoich.:	ABC4D10E14 (1)
Weight, g/mol:	351.8549
ΔH_f, kcal/mol:	96.88
Dipole, Da:	4.27
IP(EA), eV:	-8.6(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-(5-bromo-3-chloropyridin-2-yl)pyrazol-3-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N)C2=NC=CN2C3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations