Geometry & MOs

Info

ID:	24735
PubChem CID:	612801
Reduced:	OC15H24 (2)
Stoich.:	AB15C24 (2)
Weight, g/mol:	440.365431
ΔH_f, kcal/mol:	-161.84
Dipole, Da:	3.95
IP(EA), eV:	-8.89(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4,4,6a,6b,8a,11,11,14b-octamethyl-3,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-2H-picen-1-one

Drug info:

PubChemData

Smile

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=O)CC(C5(C)C)O)C)C)C2C1)C)C)C

DOS

IR

Vibrations