[(1E)-1-Nitro-1-Propen-2-Yl]Benzene

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Properties Simple | Detailed

Formula C9H9NO2
IUPAC Name [(e)-1-methyl-2-nitro-vinyl]benzene
Molecular Mass 163.173 g·mol−1
Heat of Formation 82.5 ± 16.7 kJ·mol−1
Dipole Moment 5.69 ± 1.08 D
Volume 197.13 Å 3
Surface Area 195.54 Å 2
HOMO Energy -10.22 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
Synonyms
  • [(e)-1-methyl-2-nitro-vinyl]benzene
  • [(e)-1-methyl-2-nitrovinyl]benzene
  • [(e)-1-nitroprop-1-en-2-yl]benzene
InChIKey KFNFMBKUWFTFAE-BQYQJAHWSA-N
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