Pentachloroaniline

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Properties Simple | Detailed

Formula C6H2Cl5N
IUPAC Name 2,3,4,5,6-pentachloroaniline
Molecular Mass 265.352 g·mol−1
Heat of Formation -66.5 ± 16.7 kJ·mol−1
Dipole Moment 3.93 ± 1.08 D
Volume 228.7 Å 3
Surface Area 211.6 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C2v
Synonyms
  • (2,3,4,5,6-pentachlorophenyl)amine
  • 2,3,4,5,6-pentachlorobenzenamine
  • aniline, 2,3,4,5,6-pentachloro-
  • benzenamine, 2,3,4,5,6-pentachloro-
  • benzenamine, 2,3,4,5,6-pentachloro- (9ci)
  • pca (van)
  • pentachloroaminobenzene
CAS Number(s)
  • 527-20-8
InChIKey KHCZSJXTDDHLGJ-UHFFFAOYSA-N
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Elements H C N Cl