β-Methyl-β-Nitrostyrene

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Properties Simple | Detailed

Formula C9H9NO2
IUPAC Name [(z)-2-nitroprop-1-enyl]benzene
Molecular Mass 163.173 g·mol−1
Heat of Formation 98.5 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 201.12 Å 3
Surface Area 194.46 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
Synonyms
  • [(z)-2-nitroprop-1-enyl]benzene
InChIKey WGSVFWFSJDAYBM-FPLPWBNLSA-N
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