Benzofuroxan

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Properties Simple | Detailed

Formula C6H13N2O2++
IUPAC Name 1-oxido-2,1,3-benzoxadiazol-1-ium
Molecular Mass 145.180 g·mol−1
Heat of Formation 301.0 ± 16.7 kJ·mol−1
Dipole Moment 3.38 ± 1.08 D
Volume 144.24 Å 3
Surface Area 151.12 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.45 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-benzo-2-oxa-1,3-diazole oxide
  • 1-oxidobenzofurazan-1-ium
  • 2,1,3-benzoxadiazole 1-oxide
  • 2,1,3-benzoxadiazole, 1-oxide
  • benzofurazan 1-oxide
  • benzofurazan n-oxide
  • benzofurazan oxide
  • benzofurazan, 1-oxide
  • benzofuroxane
CAS Number(s)
  • 114044-18-7
  • 54182-68-2
  • 60295-94-5
  • 68100-26-5
  • 480-96-6
InChIKey OKEAMBAZBICIFP-UHFFFAOYSA-N
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