3-Methyl-1-(4-Nitrophenyl)Triaz-1-Ene

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Properties Simple | Detailed

Formula C7H8N4O2
IUPAC Name n-[(e)-methylazo]-4-nitro-aniline
Molecular Mass 180.164 g·mol−1
Heat of Formation 267.1 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 201.73 Å 3
Surface Area 208.17 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(4-nitrophenyl)-3-methyltriazene
  • 1-triazene, 1-methyl-3-(4-nitrophenyl)-
  • 1-triazene, 1-methyl-3-(4-nitrophenyl)- (9ci)
  • 1-triazene, 3-methyl-1-(4-nitrophenyl)-
  • 1-triazene,3-methyl-1-(4-nitrophenyl)-
  • 3-methyl-1-(4-nitrophenyl)triazene
  • 3-methyl-1-(p-nitrophenyl)-triazene
  • 3-methyl-1-(p-nitrophenyl)triazene
  • n-methylazo-4-nitro-aniline
  • n-methyldiazenyl-4-nitro-aniline
  • triazene, 3-methyl-1-(p-nitrophenyl)-
CAS Number(s)
  • 40643-39-8
InChIKey BDSNQOSDUXHMCI-UHFFFAOYSA-N
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