Geometry & MOs
Info
ID: |
189823 |
PubChem CID: |
77909334 |
Reduced: |
NO3C10H12 (2) |
Stoich.: |
AB3C10D12 (2) |
Weight, g/mol: |
748.238927 |
ΔHf, kcal/mol: |
-161.02 |
Dipole, Da: |
10.44 |
IP(EA), eV: |
-9.22(-1.36) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
N-[4-[2-[1-[6-methoxy-2-(4-phenoxyphenyl)quinolin-4-yl]-3-oxo-1,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,4-a]pyridin-7-yl]but-3-enylsulfamoyl]phenyl]acetamide