Geometry & MOs
Info
ID: |
326461 |
PubChem CID: |
126687605 |
Reduced: |
N3O8C54H83 (1) |
Stoich.: |
A3B8C54D83 (1) |
Weight, g/mol: |
717.456431 |
ΔHf, kcal/mol: |
-315.16 |
Dipole, Da: |
4.67 |
IP(EA), eV: |
-9.34(0.15) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
tert-butyl N-[(2S)-6-[[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]amino]-1-oxo-1-[[(2R,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]hexan-2-yl]carbamate