2-[4-(Dicyanomethylene)-2,1,3-Benzothiadiazol-7-Ylidene]Propanedinitrile

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Properties Simple | Detailed

Formula C12H4N6S
IUPAC Name 2-[4-(dicyanomethylene)-1,3-dihydro-2,1,3-benzothiadiazol-7-ylidene]propanedinitrile
Molecular Mass 264.265 g·mol−1
Heat of Formation 984.1 ± 16.7 kJ·mol−1
Dipole Moment 0.82 ± 1.08 D
Volume 290.84 Å 3
Surface Area 269.17 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy -3.35 ± eV
Point Group Symmetry C2v
InChIKey JBYHWPIWXWEPET-UHFFFAOYSA-N
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Elements H S C N