1,1-Dioxido-4H-1,2,4-Benzothiadiazin-3-Yl Methylcarbamodithioate

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Properties Simple | Detailed

Formula C9H9N3O2S3
IUPAC Name (1,1-dioxo-4h-1λ6,2,4-benzothiadiazin-3-yl) n-methylcarbamodithioate
Molecular Mass 287.382 g·mol−1
Heat of Formation -60.9 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 295.4 Å 3
Surface Area 273.4 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
Synonyms
  • (1,1-dioxo-4h-benzo[e][1,2,4]thiadiazin-3-yl) methylaminomethanedithioate
  • 4-btcdt
  • carbamodithioic acid der.
  • carbamodithioic acid, methyl-, 1,1-dioxido-2h-1,2,4-benzothiadiazin-3-yl ester
  • carbamodithioic acid, methyl-, 2h-1,2,4-benzothiadiazin-3-yl ester, s,s-dioxide
  • carbamodithioic acid, methyl-, s-(4h-1,2,4-benzothiadiazin- 3-yl) ester, 1,1-dioxide
  • methyl-4h-1,2,4-benzothiadiazin-3-yl-carbamodithioate-s,s-dioxide
  • methylaminomethanedithioic acid (1,1-diketo-4h-benzo[e][1,2,4]thiadiazin-3-yl) ester
  • methylaminomethanedithioic acid (1,1-dioxo-4h-benzo[e][1,2,4]thiadiazin-3-yl) ester
CAS Number(s)
  • 87344-00-1
InChIKey GAAWVSXXMPHDDL-UHFFFAOYSA-N
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