2-(P-Tolylsulfonyl)-1,3,2-Dithiazole-4,5-Dicarbonitrile

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Properties Simple | Detailed

Formula C11H7N3O2S3
IUPAC Name 2-(p-tolylsulfonyl)-1,3,2-dithiazole-4,5-dicarbonitrile
Molecular Mass 309.387 g·mol−1
Heat of Formation 172.8 ± 16.7 kJ·mol−1
Dipole Moment 3.17 ± 1.08 D
Volume 323.34 Å 3
Surface Area 273.17 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 1.02 ± eV
Point Group Symmetry Cs
InChIKey NDBZVJLXUXMUOC-UHFFFAOYSA-N
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