| Formula |
C23H22ClN3O2 |
| IUPAC Name |
3-[3-chloro-5-[5-[[(1s)-1-phenylethyl]amino]isoxazolo[5,4-c]pyridin-3-yl]phenyl]propan-1-ol |
| Molecular Mass |
407.893 g·mol−1 |
| Heat of Formation |
110.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.95 ± 1.08 D |
| Volume |
481.27 Å 3 |
| Surface Area |
426.14 Å 2 |
| HOMO Energy |
-8.58 ± 0.55 eV |
| LUMO Energy |
1.96 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MMGKIHLBFPJYJL-HNNXBMFYSA-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
Cl
|
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