Geometry & MOs
Info
ID: |
313220 |
PubChem CID: |
126612656 |
Reduced: |
FSO2N3H20C22 (1) |
Stoich.: |
ABC2D3E20F22 (1) |
Weight, g/mol: |
766.486728 |
ΔHf, kcal/mol: |
-9.31 |
Dipole, Da: |
3.45 |
IP(EA), eV: |
-8.71(-1.03) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R,3S,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-2-[[(3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2Z)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol