Geometry & MOs
Info
ID: |
149123 |
PubChem CID: |
53788795 |
Reduced: |
N5O5C25H27 (1) |
Stoich.: |
A5B5C25D27 (1) |
Weight, g/mol: |
766.574755 |
ΔHf, kcal/mol: |
-106.06 |
Dipole, Da: |
4.02 |
IP(EA), eV: |
-8.2(-0.49) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3-[(4R)-4-[(3R,5R,10S,12S,13R,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]oxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid