Geometry & MOs
Info
ID: |
189333 |
PubChem CID: |
77841951 |
Reduced: |
OC14H14 (1) |
Stoich.: |
AB14C14 (1) |
Weight, g/mol: |
826.517743 |
ΔHf, kcal/mol: |
-2.85 |
Dipole, Da: |
1.89 |
IP(EA), eV: |
-8.74(-0.43) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-hydroxy-5-[[3-(1H-imidazol-5-yl)-2-[[2-[(2-morpholin-4-ylacetyl)amino]-3-phenylpropanoyl]amino]propanoyl]amino]-N-[3-methyl-1-oxo-1-(tetrazolidin-5-ylmethylamino)pentan-2-yl]-2-propan-2-yloctanamide