Geometry & MOs
Info
ID: |
310257 |
PubChem CID: |
126577437 |
Reduced: |
NOC9H13 (1) |
Stoich.: |
ABC9D13 (1) |
Weight, g/mol: |
2104.574581 |
ΔHf, kcal/mol: |
-9.88 |
Dipole, Da: |
0.81 |
IP(EA), eV: |
-9.34(0.3) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
8-amino-N-[4-[2,6-bis[[(4R)-4-(3,7,12-trihydroxy-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]amino]hexanoylamino]butyl]-N-[3-[2,6-bis[[(4R)-4-(3,7,12-trihydroxy-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]amino]hexanoylamino]propyl]octanamide