Geometry & MOs

Info

ID:

386104

PubChem CID:

134980786

Reduced:

O4C11H16 (1)

Stoich.:

A4B11C16 (1)

Weight, g/mol:

166.135765

ΔHf, kcal/mol:

-188.67

Dipole, Da:

1.49

IP(EA), eV:

-10.22(0.31)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-methyl-4-methylidene-1-oxaspiro[4.5]decane

Drug info:

PubChemData

Smile

CC1C[C@H](C=C[C@@H]1OC(=O)C)OC(=O)C

DOS

IR

Vibrations