Geometry & MOs
Info
ID: |
433031 |
PubChem CID: |
135173168 |
Reduced: |
NCl2O6C59H77 (1) |
Stoich.: |
AB2C6D59E77 (1) |
Weight, g/mol: |
398.24571 |
ΔHf, kcal/mol: |
-110.99 |
Dipole, Da: |
2.66 |
IP(EA), eV: |
-8.58(-0.68) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(8S,9S,10R,13S,14S,17R)-17-methoxy-10,13-dimethyl-17-(3-methylbutanoyl)-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione