| Formula |
C23H22Cl3NO3S |
| IUPAC Name |
(5r)-2-(2-chlorophenyl)sulfanyl-5-[2,6-dichloro-3-(tetrahydropyran-4-ylamino)phenyl]-3-hydroxy-cyclohex-2-en-1-one |
| Molecular Mass |
498.850 g·mol−1 |
| Heat of Formation |
-468.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.64 ± 1.08 D |
| Volume |
529.78 Å 3 |
| Surface Area |
432.01 Å 2 |
| HOMO Energy |
-8.39 ± 0.55 eV |
| LUMO Energy |
2.44 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
CJPAFXZVJQAZMQ-CYBMUJFWSA-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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