Geometry & MOs

Info

ID:	303119
PubChem CID:	124489234
Reduced:	N2O3C21H24 (1)
Stoich.:	A2B3C21D24 (1)
Weight, g/mol:	228.997099
ΔH_f, kcal/mol:	-88.84
Dipole, Da:	5.46
IP(EA), eV:	-8.18(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-3,5-dinitro-6-oxocyclohexa-2,4-dien-1-imine oxide

Drug info:

PubChemData

Smile

C[C@H](CNC(=O)[C@H]1CC(=O)N(C1)C2=CC=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations