Geometry & MOs
Info
ID: |
57018 |
PubChem CID: |
22395227 |
Reduced: |
NOSC7H9 (1) |
Stoich.: |
ABCD7E9 (1) |
Weight, g/mol: |
784.062887 |
ΔHf, kcal/mol: |
-15.17 |
Dipole, Da: |
2.65 |
IP(EA), eV: |
-9.14(-0.06) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(4-methoxyphenyl)methyl 7-[[(2E)-2-[[(2-chloroacetyl)amino]-(1,3-thiazol-4-yl)methoxy]iminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanyl]-3-methylsulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate