2-[2-(2H-Tetrazol-5-Yl)Ethyl]-1H-Isoindole-1,3(2H)-Dione

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Properties Simple | Detailed

Formula C11H9N5O2
IUPAC Name 2-[2-(2,3-diaza-1-azonia-4-azanidacyclopenta-2,5-dien-5-yl)ethyl]isoindoline-1,3-dione
Molecular Mass 243.221 g·mol−1
Heat of Formation 96.9 ± 16.7 kJ·mol−1
Dipole Moment 10.29 ± 1.08 D
Volume 265.44 Å 3
Surface Area 247.56 Å 2
HOMO Energy -10.75 ± 0.55 eV
LUMO Energy 1.13 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-(2h-1,2,3,4-tetrazol-5-yl)ethyl]isoindole-1,3-dione
  • 2-[2-(2h-tetrazol-5-yl)ethyl]isoindole-1,3-dione
  • 2-[2-(2h-tetrazol-5-yl)ethyl]isoindoline-1,3-dione
  • 2-[2-(2h-tetrazol-5-yl)ethyl]isoindoline-1,3-quinone
  • isoindole-1,3-dione, 2-[2-(2h-tetrazol-5-yl)ethyl]-
InChIKey DEOJDUHRJBKATO-UHFFFAOYSA-N
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