| Formula |
C26H15ClF3NO7 |
| IUPAC Name |
3-[(2s)-2-(7-chloro-1,3-benzodioxol-5-yl)-4-hydroxy-5-oxo-3-[3-(trifluoromethyl)benzoyl]-2h-pyrrol-1-yl]benzoic acid |
| Molecular Mass |
545.848 g·mol−1 |
| Heat of Formation |
-1374.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.27 ± 1.08 D |
| Volume |
557.9 Å 3 |
| Surface Area |
461.79 Å 2 |
| HOMO Energy |
-9.41 ± 0.55 eV |
| LUMO Energy |
-1.33 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XYQJDZQSXLXEJQ-FQEVSTJZSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
F
O
N
|
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