Geometry & MOs
Info
ID: |
170399 |
PubChem CID: |
75227867 |
Reduced: |
ClSN2O5C18H21 (1) |
Stoich.: |
ABC2D5E18F21 (1) |
Weight, g/mol: |
843.449054 |
ΔHf, kcal/mol: |
-164.99 |
Dipole, Da: |
3.54 |
IP(EA), eV: |
-8.82(-0.77) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[[2-[2-[[4-[[3-acetamido-1-[[1-[[1-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobut-2-enoyl]amino]propanoylamino]acetyl]amino]-3-phenylpropanoic acid