Geometry & MOs

Info

ID:	342225
PubChem CID:	127265002
Reduced:	N2O2C11H12 (2)
Stoich.:	A2B2C11D12 (2)
Weight, g/mol:	264.049469
ΔH_f, kcal/mol:	-89.33
Dipole, Da:	2.65
IP(EA), eV:	-8.85(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(E)-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C3CCCN3C(=O)C4=CC(=C(C=C4)OCC(=O)N)OC

DOS

IR

Vibrations