Geometry & MOs

Info

ID:	302507
PubChem CID:	124361994
Reduced:	OC13H24 (1)
Stoich.:	AB13C24 (1)
Weight, g/mol:	343.214744
ΔH_f, kcal/mol:	-86.43
Dipole, Da:	1.55
IP(EA), eV:	-9.05(1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3aS,5aS,9bR)-5a,9-dimethyl-3-[(4-methylpiperidin-1-yl)methyl]-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2,8-dione

Drug info:

PubChemData

Smile

C[C@H]1C=C(CC[C@]1(C)CC[C@H](C)O)C

DOS

IR

Vibrations