Formula |
C20H20N2O10 |
IUPAC Name |
3-[(r)-carboxy-[2-[[(r)-carboxy-(5-carboxy-2-hydroxy-phenyl)methyl]amino]ethylamino]methyl]-4-hydroxy-benzoic acid |
Molecular Mass |
448.380 g·mol−1 |
Heat of Formation |
-1683.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.79 ± 1.08 D |
Volume |
489.68 Å 3 |
Surface Area |
367.61 Å 2 |
HOMO Energy |
-9.45 ± 0.55 eV |
LUMO Energy |
-0.70 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CSYBRFPVPBZLCX-HOTGVXAUSA-N |
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Elements |
H
C
O
N
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