| Formula |
C21H26N2O5 |
| IUPAC Name |
5-[(2s)-4-methyl-2-[[(2-pyrrol-1-ium-3-id-3-ylacetyl)amino]methyl]pentyl]-1,3-benzodioxole-4-carboxylic acid |
| Molecular Mass |
386.442 g·mol−1 |
| Heat of Formation |
-805.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.85 ± 1.08 D |
| Volume |
472.03 Å 3 |
| Surface Area |
348.3 Å 2 |
| HOMO Energy |
-8.96 ± 0.55 eV |
| LUMO Energy |
2.02 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
NTYRVXHMFKAXSQ-HNNXBMFYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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