Geometry & MOs

Info

ID:	8404
PubChem CID:	77256
Reduced:	N3O4H5C8 (1)
Stoich.:	A3B4C5D8 (1)
Weight, g/mol:	207.028006
ΔH_f, kcal/mol:	-9.1
Dipole, Da:	5.61
IP(EA), eV:	-9.76(-2.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(dihydroxyamino)phthalazine-1,4-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)N(O)O)C(=O)N=NC2=O

DOS

IR

Vibrations