5-Acetyl-6-Hydroxy-2H-1,3-Thiazine-2,4(3H)-Dione

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Properties Simple | Detailed

Formula C6H5NO4S+
IUPAC Name 5-acetyl-6-hydroxy-1,3-thiazine-2,4-dione
Molecular Mass 187.173 g·mol−1
Heat of Formation -599.1 ± 16.7 kJ·mol−1
Dipole Moment 3.34 ± 1.08 D
Volume 189.49 Å 3
Surface Area 185.94 Å 2
HOMO Energy -10.20 ± 0.55 eV
LUMO Energy 0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 5-acetyl-6-hydroxy-1,3-thiazine-2,4-quinone
  • 5-ethanoyl-6-hydroxy-1,3-thiazine-2,4-dione
  • zero/009502
InChIKey QXSJHXWCIHEKPX-UHFFFAOYSA-N
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