1-Benzothiophen-6-Amine 1,1-Dioxide

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Properties Simple | Detailed

Formula C8H7NO2S
IUPAC Name 1,1-dioxobenzothiophen-6-amine
Molecular Mass 181.212 g·mol−1
Heat of Formation -120.7 ± 16.7 kJ·mol−1
Dipole Moment 6.40 ± 1.08 D
Volume 192.37 Å 3
Surface Area 188.79 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry Cs
Synonyms
  • (1,1-diketobenzothiophen-6-yl)amine
  • 1,1-dioxo-1-benzothiophen-6-amine
  • 1,1-dioxo-6-benzothiophenamine
  • mwp 00044
  • sdccgmls-0066184.p001
InChIKey KRUCRVZSHWOMHC-UHFFFAOYSA-N
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