Geometry & MOs

Info

ID:	20283
PubChem CID:	582930
Reduced:	O4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	236.104859
ΔH_f, kcal/mol:	-170.87
Dipole, Da:	5.01
IP(EA), eV:	-10.16(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-methylidene-1-oxo-3a,4,6,6a,7,7a-hexahydro-3H-pentaleno[1,2-c]furan-3b-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C12CC(=C)CC1CC3C2COC3=O

DOS

IR

Vibrations