Geometry & MOs
Info
ID: |
150985 |
PubChem CID: |
53790682 |
Reduced: |
NC24H41 (1) |
Stoich.: |
AB24C41 (1) |
Weight, g/mol: |
508.058337 |
ΔHf, kcal/mol: |
-44.92 |
Dipole, Da: |
4.99 |
IP(EA), eV: |
-10.31(-0.12) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(6S,7R)-7-[[2-(4-cyano-3-oxo-1,2-oxazol-5-yl)acetyl]amino]-3-[methoxy-(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid