Geometry & MOs
Info
ID: |
435010 |
PubChem CID: |
135177338 |
Reduced: |
OC12H12 (1) |
Stoich.: |
AB12C12 (1) |
Weight, g/mol: |
1312.49398 |
ΔHf, kcal/mol: |
28.23 |
Dipole, Da: |
3.11 |
IP(EA), eV: |
-9.72(-0.88) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R)-2-[3-[[(2S)-2-[[(2S)-4-amino-2-[3-[2-[2-[2-[2-[(3-ethyl-3-iodopentanoyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-4-oxobutanoyl]amino]-4-[[(1R)-1-[1-benzyl-4-(2,5-difluorophenyl)pyrrol-2-yl]-2,2-dimethylpropyl]-(2-hydroxyacetyl)amino]butanoyl]amino]propanoylamino]pentanedioic acid