| Formula |
C21H18F3N3O4S2 |
| IUPAC Name |
2-[5-(2,4-dimethylphenyl)sulfonyl-6-oxo-pyrimidin-2-yl]sulfanyl-n-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Mass |
497.511 g·mol−1 |
| Heat of Formation |
-1078.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.94 ± 1.08 D |
| Volume |
517.64 Å 3 |
| Surface Area |
450.65 Å 2 |
| HOMO Energy |
-9.60 ± 0.55 eV |
| LUMO Energy |
-1.81 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XHKKCXMZBGDTIT-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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