Formula |
C19H20ClN3O4S2 |
IUPAC Name |
s-[2-(2-chloro-4-sulfamoyl-anilino)-2-oxo-ethyl] 6-methyl-3,4-dihydro-2h-quinoline-1-carbothioate |
Molecular Mass |
453.963 g·mol−1 |
Heat of Formation |
-547.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.75 ± 1.08 D |
Volume |
484.79 Å 3 |
Surface Area |
431.4 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
-1.23 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AWAKIULNKVOBKE-UHFFFAOYSA-N |
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Links |
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Elements |
C
Cl
H
O
N
S
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