Geometry & MOs
Info
ID: |
43159 |
PubChem CID: |
10318959 |
Reduced: |
SC13H13 (2) |
Stoich.: |
AB13C13 (2) |
Weight, g/mol: |
402.329794 |
ΔHf, kcal/mol: |
121.88 |
Dipole, Da: |
2.91 |
IP(EA), eV: |
-8.24(-1.02) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1S,5R,8S,13R,14S,17R)-1-fluoro-5,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,3,4,6,7,8,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-2-one