Geometry & MOs

Info

ID:	216653
PubChem CID:	85086564
Reduced:	SO4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	288.20893
ΔH_f, kcal/mol:	-205.15
Dipole, Da:	5.62
IP(EA), eV:	-10.0(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-11-methylidene-4-pent-4-enyl-1,4,4a,5,6,9,10,11a-octahydrocyclonona[c]pyran-3-one

Drug info:

PubChemData

Smile

CCCCC1C=C2CC(OS(=O)(=O)C2(CC1O)C)C

DOS

IR

Vibrations