| Formula |
C17H13ClFN3O |
| IUPAC Name |
1-[[(2r,3s)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-diene |
| Molecular Mass |
329.756 g·mol−1 |
| Heat of Formation |
123.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.97 ± 1.08 D |
| Volume |
365.95 Å 3 |
| Surface Area |
308.01 Å 2 |
| HOMO Energy |
-9.86 ± 0.55 eV |
| LUMO Energy |
2.19 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-[[(2r,3s)-3-(2-chlorophenyl)-2-(4-fluorophenyl)-2-oxiranyl]methyl]-1,2,4-triazole
- 1-[[(2r,3s)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl]-1,2,4-triazole
|
| InChIKey |
ZMYFCFLJBGAQRS-IRXDYDNUSA-N |
| QR Code |
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| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
C
F
H
Cl
O
N
|
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