N,N-Dimethyl-1,2-Benzothiazol-3-Amine 1,1-Dioxide

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Properties Simple | Detailed

Formula C9H10N2O2S
IUPAC Name n,n-dimethyl-1,1-dioxo-1,2-benzothiazol-3-amine
Molecular Mass 210.253 g·mol−1
Heat of Formation -91.2 ± 16.7 kJ·mol−1
Dipole Moment 7.41 ± 1.08 D
Volume 228.95 Å 3
Surface Area 217.4 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -1.42 ± eV
Point Group Symmetry C1
Synonyms
  • (1,1-diketo-1,2-benzothiazol-3-yl)-dimethyl-amine
  • 1,2-benzisothiazol-3-amine, n,n-dimethyl-, 1,1-dioxide
  • 3-dimethylamino-psi-saccharin
  • n,n-dimethyl-1,1-dioxo-1,2-benzothiazol-3-amine
  • n,n-dimethyl-1,2-benzisothiazol-3-amine 1,1-dioxide
CAS Number(s)
  • 22716-43-4
InChIKey GTLJDAHQXYGVCG-UHFFFAOYSA-N
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