Formula |
C12H13NO3S3 |
IUPAC Name |
s-[(1s)-1-methyl-2-oxo-2-[[(3s)-2-oxotetrahydrothiophen-3-yl]amino]ethyl] thiophene-2-carbothioate |
Molecular Mass |
315.432 g·mol−1 |
Heat of Formation |
-379.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.22 ± 1.08 D |
Volume |
348.92 Å 3 |
Surface Area |
306.01 Å 2 |
HOMO Energy |
-9.18 ± 0.55 eV |
LUMO Energy |
1.59 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MKTVMEMIKNBVHI-YUMQZZPRSA-N |
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Links |
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Elements |
H
S
C
O
N
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