Geometry & MOs
Info
ID: |
326489 |
PubChem CID: |
126687658 |
Reduced: |
N2O7C31H48 (1) |
Stoich.: |
A2B7C31D48 (1) |
Weight, g/mol: |
588.377452 |
ΔHf, kcal/mol: |
-287.91 |
Dipole, Da: |
4.58 |
IP(EA), eV: |
-9.48(0.33) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[(2S)-3-methyl-1-oxo-1-[[(2R,3S,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]butan-2-yl]docosa-4,7,10,13,16,19-hexaenamide