| Formula |
C21H17BrFN3O4S |
| IUPAC Name |
2-[1-[(5-bromo-2-fluoro-phenyl)methyl]indol-1-ium-3-yl]sulfonyl-n-(5-methylisoxazol-3-yl)acetamide |
| Molecular Mass |
506.345 g·mol−1 |
| Heat of Formation |
-379.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.83 ± 1.08 D |
| Volume |
502.19 Å 3 |
| Surface Area |
369.24 Å 2 |
| HOMO Energy |
-9.22 ± 0.55 eV |
| LUMO Energy |
-0.95 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
RUYRNYRGPSAXTK-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
Br
|
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