Geometry & MOs

Info

ID:	179185
PubChem CID:	76447690
Reduced:	SiO4C21H36 (1)
Stoich.:	AB4C21D36 (1)
Weight, g/mol:	440.365431
ΔH_f, kcal/mol:	-262.19
Dipole, Da:	3.17
IP(EA), eV:	-8.88(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-hydroxy-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysen-9-one

Drug info:

PubChemData

Smile

CC1CC(CC2C1(C(C3(C2)C(=C)COC3=O)O)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations