| Formula |
C17H12F3N3O4S |
| IUPAC Name |
4-[2-(4-sulfamoylphenyl)-5-(trifluoromethyl)-4h-pyrazol-2-ium-4-id-3-yl]benzoic acid |
| Molecular Mass |
411.355 g·mol−1 |
| Heat of Formation |
-936.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.57 ± 1.08 D |
| Volume |
420.14 Å 3 |
| Surface Area |
366.74 Å 2 |
| HOMO Energy |
-10.32 ± 0.55 eV |
| LUMO Energy |
1.34 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-[2-(4-sulfamoylphenyl)-5-(trifluoromethyl)-3-pyrazolyl]benzoic acid
- 4-[2-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid
|
| InChIKey |
WTHNOVFEXONZMI-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
|
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