Formula |
C23H30N2O6 |
IUPAC Name |
(2s)-2-[3-[[(r)-carboxy-(2-hydroxy-3,5-dimethyl-phenyl)methyl]amino]propylamino]-2-(2-hydroxy-3,5-dimethyl-phenyl)acetic acid |
Molecular Mass |
430.494 g·mol−1 |
Heat of Formation |
-1082.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.11 ± 1.08 D |
Volume |
527.08 Å 3 |
Surface Area |
404.63 Å 2 |
HOMO Energy |
-8.75 ± 0.55 eV |
LUMO Energy |
0.07 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OJVWNIOUUIQEBC-KDURUIRLSA-N |
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Elements |
H
C
O
N
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