6-Chloro-N-Isopropyl-4H-Thieno[3,2-E][1,2,4]Thiadiazin-3-Amine 1,1-Dioxide

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Properties Simple | Detailed

Formula C8H10ClN3O2S2
IUPAC Name 6-chloro-n-isopropyl-1,1-dioxo-4h-thieno[3,2-e][1,2,4]thiadiazin-3-amine
Molecular Mass 279.767 g·mol−1
Heat of Formation -199.0 ± 16.7 kJ·mol−1
Dipole Moment 7.78 ± 1.08 D
Volume 282.38 Å 3
Surface Area 265.13 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.26 ± eV
Point Group Symmetry C1
Synonyms
  • (6-chloro-1,1-diketo-4h-thieno[3,2-e][1,2,4]thiadiazin-3-yl)-isopropyl-amine
  • 6-chloro-1,1-dioxo-n-propan-2-yl-4h-thieno[3,2-e][1,2,4]thiadiazin-3-amine
  • 6-chloro-n-isopropyl-1,1-dioxo-4h-thieno[3,2-e][1,2,4]thiadiazin-3-amine
  • nnc-55-0118
InChIKey NDBOSDQLHXHDSC-UHFFFAOYSA-N
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