Geometry & MOs
Info
ID: |
436485 |
PubChem CID: |
135203965 |
Reduced: |
ClO2N3C12H14 (1) |
Stoich.: |
AB2C3D12E14 (1) |
Weight, g/mol: |
462.261754 |
ΔHf, kcal/mol: |
-57.99 |
Dipole, Da: |
5.69 |
IP(EA), eV: |
-9.13(-1.0) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
5-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-7-yl]pentanoic acid