| Formula |
C21H19F6N5O |
| IUPAC Name |
(2s,5s)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-n-[6-(trifluoromethyl)-3-pyridyl]piperazine-1-carboxamide |
| Molecular Mass |
471.399 g·mol−1 |
| Heat of Formation |
-1133.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
12.93 ± 1.08 D |
| Volume |
504.51 Å 3 |
| Surface Area |
433.61 Å 2 |
| HOMO Energy |
-9.15 ± 0.55 eV |
| LUMO Energy |
1.79 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
JKMJQRRLCJXPOK-STQMWFEESA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
F
|
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