N-(3-Fluorophenyl)-4-Nitro-2,1,3-Benzoxadiazol-5-Amine

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Properties Simple | Detailed

Formula C12H7FN4O3
IUPAC Name n-(3-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Molecular Mass 274.207 g·mol−1
Heat of Formation 215.3 ± 16.7 kJ·mol−1
Dipole Moment 7.80 ± 1.08 D
Volume 279.4 Å 3
Surface Area 261.47 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -2.46 ± eV
Point Group Symmetry C1
Synonyms
  • (3-fluorophenyl)-(4-nitrobenzofurazan-5-yl)amine
InChIKey QMETXUTZEYHEJB-UHFFFAOYSA-N
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