Geometry & MOs
Info
ID: |
127085 |
PubChem CID: |
50990398 |
Reduced: |
N3O3C13H15 (1) |
Stoich.: |
A3B3C13D15 (1) |
Weight, g/mol: |
520.303618 |
ΔHf, kcal/mol: |
-44.09 |
Dipole, Da: |
3.65 |
IP(EA), eV: |
-8.89(-0.48) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3S,4S,5R)-4-[(2R,3R)-2,3-dihydroxy-3-[(2S,3R,5R,9R,10R,13R,14S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]-3,5-dimethyloxolan-2-one