Geometry & MOs

Info

ID:

220101

PubChem CID:

85165243

Reduced:

O2C22H29 (2)

Stoich.:

A2B22C29 (2)

Weight, g/mol:

650.385649

ΔHf, kcal/mol:

-160.19

Dipole, Da:

1.54

IP(EA), eV:

 -8.55(0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3,17-bis[[tert-butyl(dimethyl)silyl]oxy]-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-11-yl]butyl methanesulfonate

Drug info:

PubChemData

Smile

CC(CCOC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C4CCC5C4(CCC6C5CCC7C6(CCC(C7)O)C)C

DOS

IR

Vibrations