Geometry & MOs

Info

ID:	21185
PubChem CID:	587486
Reduced:	NO2H4C6 (2)
Stoich.:	AB2C4D6 (2)
Weight, g/mol:	244.048407
ΔH_f, kcal/mol:	37.9
Dipole, Da:	9.36
IP(EA), eV:	-9.78(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dinitro-1,2-dihydroacenaphthylene

Drug info:

PubChemData

Smile

C1CC2=CC(=C(C3=CC=CC1=C23)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations