Geometry & MOs

Info

ID:

21203

PubChem CID:

587623

Reduced:

OC11H18 (3)

Stoich.:

AB11C18 (3)

Weight, g/mol:

498.407296

ΔHf, kcal/mol:

-210.09

Dipole, Da:

3.24

IP(EA), eV:

 -9.39(0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[17-(2,5-dimethyl-5-propan-2-ylfuran-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Drug info:

PubChemData

Smile

CC(C)C1(C=CC(O1)(C)C2CCC3(C2CCC4C3(CCC5C4(CCC(C5(C)C)OC(=O)C)C)C)C)C

DOS

IR

Vibrations