Geometry & MOs

Info

ID:	22362
PubChem CID:	596948
Reduced:	OC3H4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	224.104859
ΔH_f, kcal/mol:	-175.52
Dipole, Da:	3.81
IP(EA), eV:	-10.78(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C2(CCCCC2)OC1=O)C(=O)OC

DOS

IR

Vibrations