Geometry & MOs
Info
ID: |
161542 |
PubChem CID: |
57391946 |
Reduced: |
NPO5C7H16 (1) |
Stoich.: |
ABC5D7E16 (1) |
Weight, g/mol: |
458.375995 |
ΔHf, kcal/mol: |
-303.27 |
Dipole, Da: |
4.08 |
IP(EA), eV: |
-9.68(0.09) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6,12-triol