Geometry & MOs
Info
ID: |
232914 |
PubChem CID: |
87577622 |
Reduced: |
NO2C15H33 (1) |
Stoich.: |
AB2C15D33 (1) |
Weight, g/mol: |
601.397853 |
ΔHf, kcal/mol: |
-161.53 |
Dipole, Da: |
1.79 |
IP(EA), eV: |
-9.18(2.13) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-4-[2-[(2-hydroxyacetyl)-methoxyamino]acetyl]-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid