Geometry & MOs
Info
ID: |
232194 |
PubChem CID: |
87575684 |
Reduced: |
O3C22H42 (1) |
Stoich.: |
A3B22C42 (1) |
Weight, g/mol: |
568.35526 |
ΔHf, kcal/mol: |
-139.9 |
Dipole, Da: |
2.58 |
IP(EA), eV: |
-9.85(-0.2) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol