1,3-Dithiane

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Properties Simple | Detailed

Formula C4H8S2
IUPAC Name 1,3-dithiane
Molecular Mass 120.236 g·mol−1
Heat of Formation 3.7 ± 16.7 kJ·mol−1
Dipole Moment 2.51 ± 1.08 D
Volume 142.93 Å 3
Surface Area 142.45 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-dithiacyclohexane
  • 1,3-dithian
  • dithiane-1,3
  • m-dithiane
CAS Number(s)
  • 505-23-7
InChIKey WQADWIOXOXRPLN-UHFFFAOYSA-N
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Elements H C S