Geometry & MOs
Info
ID: |
448286 |
PubChem CID: |
135289918 |
Reduced: |
SO5N6H16C19 (1) |
Stoich.: |
AB5C6D16E19 (1) |
Weight, g/mol: |
1024.612322 |
ΔHf, kcal/mol: |
-79.65 |
Dipole, Da: |
6.12 |
IP(EA), eV: |
-9.16(-1.26) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-[(3S,5S,8R,9S,10R,13R,14S,17R)-5,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4R)-4-[(8S,9S,10R,13S,14R,17R)-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl]oxolan-2-one