Geometry & MOs
Info
ID: |
326460 |
PubChem CID: |
126687602 |
Reduced: |
N3O8C54H83 (1) |
Stoich.: |
A3B8C54D83 (1) |
Weight, g/mol: |
901.618017 |
ΔHf, kcal/mol: |
-326.29 |
Dipole, Da: |
6.99 |
IP(EA), eV: |
-9.22(0.18) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[(5S)-5-[[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]amino]-6-oxo-6-[[(2R,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]hexyl]docosa-4,7,10,13,16,19-hexaenamide