Formula |
C18H14F3N3O6S |
IUPAC Name |
1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione |
Molecular Mass |
457.380 g·mol−1 |
Heat of Formation |
-1428.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.63 ± 1.08 D |
Volume |
459.66 Å 3 |
Surface Area |
401.01 Å 2 |
HOMO Energy |
-9.67 ± 0.55 eV |
LUMO Energy |
-1.16 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-methyl-3-(4-(p-((trifluoromethyl)sulfonyl)phenoxy)-m-tolyl)-s-triazine-2,4,6(1h,3h,5h)-trione.
- 1-methyl-3-[3-methyl-4-(4-triflylphenoxy)phenyl]-1,3,5-triazinane-2,4,6-trione
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CAS Number(s) |
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InChIKey |
VBUNOIXRZNJNAD-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
C
F
H
O
N
S
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