| Formula |
C23H23ClN2O5S |
| IUPAC Name |
3-[[4-[4-[[(1r)-1-(2-chlorophenyl)ethoxy]carbonylamino]-3-methyl-isoxazol-5-yl]phenyl]methylsulfanyl]propanoic acid |
| Molecular Mass |
474.957 g·mol−1 |
| Heat of Formation |
-603.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.76 ± 1.08 D |
| Volume |
545.37 Å 3 |
| Surface Area |
406.1 Å 2 |
| HOMO Energy |
-8.69 ± 0.55 eV |
| LUMO Energy |
-0.57 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
LLIFMNUXGDHTRO-OAHLLOKOSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
|
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