| Formula |
C12H16N2O6S |
| IUPAC Name |
(2s)-2-amino-3-[3-[(2r)-2-amino-2-carboxy-ethyl]sulfanyl-4,5-dihydroxy-phenyl]propanoic acid |
| Molecular Mass |
316.330 g·mol−1 |
| Heat of Formation |
-1045.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
0.68 ± 1.08 D |
| Volume |
354.28 Å 3 |
| Surface Area |
299.66 Å 2 |
| HOMO Energy |
-9.11 ± 0.55 eV |
| LUMO Energy |
-0.83 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
SXISMOAILJWTID-BQBZGAKWSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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