Geometry & MOs

Info

ID:	25356
PubChem CID:	623502
Reduced:	N3O4H11C13 (1)
Stoich.:	A3B4C11D13 (1)
Weight, g/mol:	320.039299
ΔH_f, kcal/mol:	51.49
Dipole, Da:	0.56
IP(EA), eV:	-9.29(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(dihydroxyamino)-2,6-dinitrophenyl]iminocyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations