Geometry & MOs
Info
ID: |
315923 |
PubChem CID: |
126629441 |
Reduced: |
HIC12 (1) |
Stoich.: |
ABC12 (1) |
Weight, g/mol: |
824.283396 |
ΔHf, kcal/mol: |
344.38 |
Dipole, Da: |
0.54 |
IP(EA), eV: |
-9.52(-1.32) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2,2,2-trichloroethyl (3S)-1-[(2S)-2-[[(2S)-2-[[2-[(E)-2-[2-[(1R)-1-hydroxyethyl]quinolin-7-yl]ethenyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]amino]-3-methylbutanoyl]amino]propanoyl]diazinane-3-carboxylate