Geometry & MOs
Info
ID: |
43341 |
PubChem CID: |
10321154 |
Reduced: |
SO3C27H38 (1) |
Stoich.: |
AB3C27D38 (1) |
Weight, g/mol: |
442.344695 |
ΔHf, kcal/mol: |
-117.31 |
Dipole, Da: |
7.84 |
IP(EA), eV: |
-8.46(-0.35) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(E)-3-[(3R)-3-[(3S,10S,13R,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,11,12,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]-4-methylpent-2-ene-1,4-diol