Geometry & MOs
Info
ID: |
180756 |
PubChem CID: |
76681116 |
Reduced: |
O2N3C12H13 (1) |
Stoich.: |
A2B3C12D13 (1) |
Weight, g/mol: |
921.424376 |
ΔHf, kcal/mol: |
-10.8 |
Dipole, Da: |
3.8 |
IP(EA), eV: |
-9.49(-0.96) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[7-[4-[2-[4-[2-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]ethyl]triazol-1-yl]ethyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinolin-3-yl] formate