2,2'-(4H,8H-[1,2,5]Thiadiazolo[3,4-F][2,1,3]Benzothiadiazole-4,8-Diylidene)Dimalononitrile

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Formula C12N8S2
IUPAC Name 2-[8-(dicyanomethylidene)-[1,2,5]thiadiazolo[3,4-f][2,1,3]benzothiadiazol-4-ylidene]propanedinitrile
Molecular Mass 320.312 g·mol−1
Heat of Formation 1185.2 ± 16.7 kJ·mol−1
Dipole Moment 0.03 ± 1.08 D
Volume 327.97 Å 3
Surface Area 294.81 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry D2h
Synonyms
  • 2-[8-(dicyanomethylene)-[1,2,5]thiadiazolo[3,4-f][2,1,3]benzothiadiazol-4-ylidene]malononitrile
  • 2-[8-(dicyanomethylene)-[1,2,5]thiadiazolo[3,4-f][2,1,3]benzothiadiazol-4-ylidene]propanedinitrile
  • 2-[8-(dicyanomethylidene)-[1,2,5]thiadiazolo[3,4-f][2,1,3]benzothiadiazol-4-ylidene]propanedinitrile
  • nci60_006656
  • nsc622615
InChIKey WWJXWOZMFLRPQR-UHFFFAOYSA-N
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