Geometry & MOs

Info

ID:	387505
PubChem CID:	134985618
Reduced:	C4H5N5O11 (1)
Stoich.:	A4B5C5D11 (1)
Weight, g/mol:	254.090272
ΔH_f, kcal/mol:	-31.27
Dipole, Da:	3.74
IP(EA), eV:	-11.92(-2.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethoxy-4-(2-nitro-1-nitrosopropyl)benzene

Drug info:

PubChemData

Smile

C(C(C[N+](=O)[O-])O[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations