2-Chloro-3,5-Dinitrobenzoic Acid

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Properties Simple | Detailed

Formula C7H3ClN2O6
IUPAC Name 2-chloro-3,5-dinitro-benzoic acid
Molecular Mass 246.562 g·mol−1
Heat of Formation -299.8 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 228.9 Å 3
Surface Area 218.77 Å 2
HOMO Energy -11.27 ± 0.55 eV
LUMO Energy -2.55 ± eV
Point Group Symmetry C1
Synonyms
  • 2-carboxy-4,6-dinitrochlorobenzene
  • benzoic acid, 2-chloro-3,5-dinitro-
CAS Number(s)
  • 2497-91-8
InChIKey ADTKEYLCJYYHHH-UHFFFAOYSA-N
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Elements H C N O Cl