Geometry & MOs
Info
ID: |
223307 |
PubChem CID: |
85334837 |
Reduced: |
SO13N19C77H149 (1) |
Stoich.: |
AB13C19D77E149 (1) |
Weight, g/mol: |
1598.689121 |
ΔHf, kcal/mol: |
-801.89 |
Dipole, Da: |
5.48 |
IP(EA), eV: |
-9.33(-0.05) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
5-[[2-[[1-[[1-[[1-[[6-amino-1-[2-[[1-[[5-amino-1-[[1-[[6-amino-1-[[1-[(1-carboxy-3-methylsulfanylpropyl)amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-2-oxoethyl]amino]-4-[(2,5-diamino-5-oxopentanoyl)amino]-5-oxopentanoic acid