Geometry & MOs

Info

ID:	267824
PubChem CID:	103589701
Reduced:	BrO3N4H9C11 (1)
Stoich.:	AB3C4D9E11 (1)
Weight, g/mol:	404.88951
ΔH_f, kcal/mol:	41.86
Dipole, Da:	5.71
IP(EA), eV:	-9.33(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])Br)NN

DOS

IR

Vibrations