Geometry & MOs

Info

ID:

405239

PubChem CID:

135073176

Reduced:

N2O4C17H27 (1)

Stoich.:

A2B4C17D27 (1)

Weight, g/mol:

222.136828

ΔHf, kcal/mol:

-109.36

Dipole, Da:

6.75

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.758027

Charge, e:

 0

Chem-info

IUPAC name:

(Z)-1-deca-3,4-dienoxy-2-diazonioethenolate

Drug info:

PubChemData

Smile

CCCCCC=C=CC(C)(C)CO/C(=C(/C(=O)OCC)\[N+]#N)/O

DOS

IR

Vibrations