1,3,4,6-Tetrathiapentalene-2,5-Dione

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Properties Simple | Detailed

Formula C4H2O2S4
IUPAC Name 3a,6a-dihydro-[1,3]dithiolo[4,5-d][1,3]dithiole-2,5-dione
Molecular Mass 210.317 g·mol−1
Heat of Formation -137.5 ± 16.7 kJ·mol−1
Dipole Moment 0.00 ± 1.08 D
Volume 190.31 Å 3
Surface Area 182.77 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.21 ± eV
Point Group Symmetry D2h
Synonyms
  • [1,3]dithiolo[4,5-d][1,3]dithiole-2,5-dione
  • [1,3]dithiolo[4,5-d][1,3]dithiole-2,5-quinone
  • rjc 03593
  • sr-01000636303-1
  • thiapendione
InChIKey XMQJUIFJLYEFQR-UHFFFAOYSA-N
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