1-Nitro-4-Phenylbutadiene

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Properties Simple | Detailed

Formula C10H9NO2
IUPAC Name [(1e,3e)-4-nitrobuta-1,3-dienyl]benzene
Molecular Mass 175.184 g·mol−1
Heat of Formation 178.9 ± 16.7 kJ·mol−1
Dipole Moment 6.49 ± 1.08 D
Volume 214.53 Å 3
Surface Area 217.23 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 1.30 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-nitro-4-phenyl-1,3-butadiene
  • [(1e,3e)-4-nitrobuta-1,3-dienyl]benzene
  • benzene, (4-nitro-1,3-butadienyl)-
CAS Number(s)
  • 4701-10-4
InChIKey HXAORLISYKTFNQ-KBXRYBNXSA-N
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