| Formula |
C16H18F3N3O3 |
| IUPAC Name |
isopropyl 3-[3-[3-methoxy-5-(trifluoromethyl)phenyl]-2-aza-1-azonia-4-azanidacyclopenta-2,5-dien-1-yl]propanoate |
| Molecular Mass |
357.328 g·mol−1 |
| Heat of Formation |
-955.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.27 ± 1.08 D |
| Volume |
400.73 Å 3 |
| Surface Area |
373.57 Å 2 |
| HOMO Energy |
-9.35 ± 0.55 eV |
| LUMO Energy |
2.13 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
QJLVYXNWBWLHFD-UHFFFAOYSA-N |
| QR Code |
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| Links |
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
F
|
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