| Formula |
C17H15ClN2O2 |
| IUPAC Name |
1-[(3s)-5-(2-chlorophenyl)-3-(3-hydroxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone |
| Molecular Mass |
314.766 g·mol−1 |
| Heat of Formation |
-82.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.42 ± 1.08 D |
| Volume |
360.75 Å 3 |
| Surface Area |
317.26 Å 2 |
| HOMO Energy |
-8.83 ± 0.55 eV |
| LUMO Energy |
2.08 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-[(5s)-3-(2-chlorophenyl)-5-(3-hydroxyphenyl)-4,5-dihydropyrazol-1-yl]ethanone
- l47
|
| InChIKey |
QBZAPFWYAPXRGQ-KRWDZBQOSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
Cl
O
N
|
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