| Formula |
C26H30FN3O5 |
| IUPAC Name |
(3s)-3-[[1-(2-fluorophenyl)-5-[(2r)-2-hydroxy-3,3-dimethyl-butoxy]pyrazol-1-ium-2-ide-3-carbonyl]amino]-3-(o-tolyl)propanoic acid |
| Molecular Mass |
483.532 g·mol−1 |
| Heat of Formation |
-812.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.25 ± 1.08 D |
| Volume |
584.23 Å 3 |
| Surface Area |
483.66 Å 2 |
| HOMO Energy |
-9.33 ± 0.55 eV |
| LUMO Energy |
2.17 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
PUJVTKSRQZHCAT-UGKGYDQZSA-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
F
O
N
|
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