Geometry & MOs

Info

ID:	23053
PubChem CID:	601471
Reduced:	N2O5H10C15 (1)
Stoich.:	A2B5C10D15 (1)
Weight, g/mol:	298.058971
ΔH_f, kcal/mol:	1.32
Dipole, Da:	9.68
IP(EA), eV:	-10.85(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,14-dinitrotricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=C1C=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations