| Formula |
C17H13ClN2O2 |
| IUPAC Name |
2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-1-ium-2-id-4-yl]acetic acid |
| Molecular Mass |
312.750 g·mol−1 |
| Heat of Formation |
-22.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.56 ± 1.08 D |
| Volume |
351.21 Å 3 |
| Surface Area |
321.68 Å 2 |
| HOMO Energy |
-9.07 ± 0.55 eV |
| LUMO Energy |
-0.78 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1h-pyrazole-4-acetic acid, 3-(4-chlorophenyl)-1-phenyl-
- 2-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]acetic acid
- 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]acetic acid
- 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]ethanoic acid
- 2-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]acetic acid
- 3-(p-chlorophenyl)-1-phenylpyrazole-4-acetic acid
|
| InChIKey |
XVUQHFRQHBLHQD-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
C
N
O
Cl
|
| |
|
