3-Nitrophthalimide

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Properties Simple | Detailed

Formula C8H4N2O4
IUPAC Name 4-nitroisoindoline-1,3-dione
Molecular Mass 192.128 g·mol−1
Heat of Formation -163.2 ± 16.7 kJ·mol−1
Dipole Moment 4.54 ± 1.08 D
Volume 190.78 Å 3
Surface Area 187.95 Å 2
HOMO Energy -11.12 ± 0.55 eV
LUMO Energy -2.12 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-isoindole-1,3(2h)-dione, 4-nitro-
  • 4-nitroisoindole-1,3-dione
  • 4-nitroisoindoline-1,3-quinone
  • oprea1_240526
  • phthalimide, 3-nitro-
CAS Number(s)
  • 603-62-3
InChIKey BONIIQYTWOPUQI-UHFFFAOYSA-N
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