Geometry & MOs

Info

ID:	24187
PubChem CID:	608357
Reduced:	NO2H4C8 (2)
Stoich.:	AB2C4D8 (2)
Weight, g/mol:	292.048407
ΔH_f, kcal/mol:	57.76
Dipole, Da:	8.91
IP(EA), eV:	-9.46(-2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,9-dinitropyrene

Drug info:

PubChemData

Smile

C1=CC2=C3C(=C1)C(=CC4=C(C=CC(=C43)C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations