Geometry & MOs
Info
ID: |
432807 |
PubChem CID: |
135172944 |
Reduced: |
NC19H39 (1) |
Stoich.: |
AB19C39 (1) |
Weight, g/mol: |
1238.494326 |
ΔHf, kcal/mol: |
-80.15 |
Dipole, Da: |
1.36 |
IP(EA), eV: |
-8.39(2.89) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R)-2-[3-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-3-carboxy-2-[[(2S)-2-[[5-(2,5-dioxopyrrolidin-1-yl)oxy-5-oxopentanoyl]amino]propanoyl]-methylamino]propanoyl]amino]-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