2-Chloro-4,6-Dinitroaniline

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Properties Simple | Detailed

Formula C6H4ClN3O4
IUPAC Name 2-chloro-4,6-dinitro-aniline
Molecular Mass 217.567 g·mol−1
Heat of Formation 4.9 ± 16.7 kJ·mol−1
Dipole Moment 5.74 ± 1.08 D
Volume 207.22 Å 3
Surface Area 200.89 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy 1.05 ± eV
Point Group Symmetry Cs
Synonyms
  • (2-chloro-4,6-dinitro-phenyl)amine
  • 6-chloro-2,4-dinitroaniline
  • aniline, 6-chloro-2,4-dinitro-
  • benzenamine, 2-chloro-4,6-dinitro-
CAS Number(s)
  • 3531-19-9
InChIKey LHRIICYSGQGXSX-UHFFFAOYSA-N
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Elements H C N O Cl