Geometry & MOs

Info

ID:	22379
PubChem CID:	597071
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	222.125594
ΔH_f, kcal/mol:	-144.31
Dipole, Da:	3.79
IP(EA), eV:	-9.86(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-8,8-dimethyl-3a,4,5,6,7,8b-hexahydro-3H-indeno[1,2-b]furan-2-one

Drug info:

PubChemData

Smile

CC1(CCC(C2=C1C3C(C2)CC(=O)O3)O)C

DOS

IR

Vibrations