Geometry & MOs

Info

ID:	28152
PubChem CID:	825895
Reduced:	NO2H4C5 (2)
Stoich.:	AB2C4D5 (2)
Weight, g/mol:	276.084517
ΔH_f, kcal/mol:	4.56
Dipole, Da:	3.94
IP(EA), eV:	-8.85(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,9-dimethyl-2,4,8,10-tetraoxaspiro[5.5]undecane-3,9-dicarboxylic acid

Drug info:

PubChemData

Smile

C1=COC=C1C(=C(C2=COC=C2)N=O)NO

DOS

IR

Vibrations