Geometry & MOs

Info

ID:	24434
PubChem CID:	610269
Reduced:	OC30H52 (1)
Stoich.:	AB30C52 (1)
Weight, g/mol:	428.401816
ΔH_f, kcal/mol:	-143.97
Dipole, Da:	1.81
IP(EA), eV:	-9.7(2.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol

Drug info:

PubChemData

Smile

CC(C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C

DOS

IR

Vibrations