Geometry & MOs

Info

ID:

179499

PubChem CID:

76490592

Reduced:

OSC13H22 (1)

Stoich.:

ABC13D22 (1)

Weight, g/mol:

750.564993

ΔHf, kcal/mol:

-66.01

Dipole, Da:

3.16

IP(EA), eV:

-8.62(0.54)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[tert-butyl(dimethyl)silyl]oxy-4-[[1-[4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxy-3-methylbutoxy]-17-ethyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CCCC(=C(C)C1CCCSC1)C(=O)C

DOS

IR

Vibrations