Geometry & MOs
Info
ID: |
59261 |
PubChem CID: |
24775849 |
Reduced: |
O3N4C23H28 (1) |
Stoich.: |
A3B4C23D28 (1) |
Weight, g/mol: |
1007.227769 |
ΔHf, kcal/mol: |
-39.5 |
Dipole, Da: |
4.94 |
IP(EA), eV: |
-8.68(-0.94) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-3-[(2R,3R,4S,5R)-5-[(2S,3R,4S,5S,6R)-4-[(2R,3R,4R,5R,6R)-5-fluoro-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-2-[[2-[(6'-hydroxy-4-isothiocyanato-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl)oxyamino]acetyl]amino]propanoic acid