Geometry & MOs
Info
ID: |
146999 |
PubChem CID: |
53776989 |
Reduced: |
OC7H7 (2) |
Stoich.: |
AB7C7 (2) |
Weight, g/mol: |
1184.288204 |
ΔHf, kcal/mol: |
-34.46 |
Dipole, Da: |
1.95 |
IP(EA), eV: |
-8.59(-0.03) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
benzhydryl (6S)-3-(1,3-benzothiazol-2-ylsulfanyl)-8-oxo-7-[[2-[2-(tritylamino)-1,3-thiazol-4-yl]-2-trityloxyiminoacetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate