Geometry & MOs
Info
ID: |
226985 |
PubChem CID: |
87559421 |
Reduced: |
NOC2H8 (2) |
Stoich.: |
ABC2D8 (2) |
Weight, g/mol: |
1145.764347 |
ΔHf, kcal/mol: |
-137.35 |
Dipole, Da: |
0.96 |
IP(EA), eV: |
-9.52(3.11) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-1-[6-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]hexanoyl]pyrrolidin-3-yl]oxy-4-oxobutanoic acid;N,N-diethylethanamine