2',4-Dinitro-2,4'-Biphenyldiamine

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Properties Simple | Detailed

Formula C12H10N4O4
IUPAC Name 2-(4-amino-2-nitrophenyl)-5-nitroaniline
Molecular Mass 274.232 g·mol−1
Heat of Formation 1832.4 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 275.59 Å 3
Surface Area 251.42 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy -2.21 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4'-diamino-2',4-dinitrobiphenyl
  • 2,4'-diamino-2,'4-dinitrobiphenyl
  • 2-(4-amino-2-nitro-phenyl)-5-nitro-aniline
  • 2-(4-amino-2-nitrophenyl)-5-nitroaniline
  • [2-(4-amino-2-nitro-phenyl)-5-nitro-phenyl]amine
  • benzenamine, 2-(4-amino-2-nitrophenyl)-5-nitro-
  • ccris 5361
CAS Number(s)
  • 133561-39-4
InChIKey VFOOHDPIWYRUFJ-UHFFFAOYSA-N
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