Formula |
C14H14N2O2S2 |
IUPAC Name |
s-[[3-(acetylsulfanylmethyl)quinoxalin-2-yl]methyl] ethanethioate |
Molecular Mass |
306.403 g·mol−1 |
Heat of Formation |
-119.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.61 ± 1.08 D |
Volume |
350.2 Å 3 |
Surface Area |
306.94 Å 2 |
HOMO Energy |
-9.20 ± 0.55 eV |
LUMO Energy |
-1.15 ± eV |
Point Group Symmetry |
C2
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Synonyms
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- ethanethioic acid s-[[3-[(acetylthio)methyl]-2-quinoxalinyl]methyl] ester
- ethanethioic acid s-[[3-[(acetylthio)methyl]quinoxalin-2-yl]methyl] ester
- ethanethioic acid, s,s'-(2,3-quinoxalinediylbis(methylene)) ester
- s-[[3-(ethanoylsulfanylmethyl)quinoxalin-2-yl]methyl] ethanethioate
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CAS Number(s) |
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InChIKey |
KIYGADXCTZZZDG-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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