Geometry & MOs

Info

ID:	267830
PubChem CID:	103589709
Reduced:	BrCl2O3N4H7C11 (1)
Stoich.:	AB2C3D4E7F11 (1)
Weight, g/mol:	342.97163
ΔH_f, kcal/mol:	28.25
Dipole, Da:	3.67
IP(EA), eV:	-9.15(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-bromo-5-nitrophenoxy)-5-fluoropyrimidin-2-yl]hydrazine

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1OC2=C(C=C(C(=N2)NN)Cl)Cl)Br)[N+](=O)[O-]

DOS

IR

Vibrations