Geometry & MOs
Info
ID: |
300562 |
PubChem CID: |
121360535 |
Reduced: |
NO3F6C12H13 (1) |
Stoich.: |
AB3C6D12E13 (1) |
Weight, g/mol: |
544.387623 |
ΔHf, kcal/mol: |
-372.52 |
Dipole, Da: |
2.32 |
IP(EA), eV: |
-9.11(-0.9) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-[2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-heptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-3-oxopropanoic acid