Geometry & MOs

Info

ID:

49180

PubChem CID:

11528794

Reduced:

O4C13H16 (1)

Stoich.:

A4B13C16 (1)

Weight, g/mol:

236.104859

ΔHf, kcal/mol:

-133.67

Dipole, Da:

1.95

IP(EA), eV:

-9.1(-0.65)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6'-hydroperoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-dioxane]

Drug info:

PubChemData

Smile

CC(=C)C1=C(C=C(C=C1OC)C(=O)OC)OC

DOS

IR

Vibrations