4-[(2,3,5-Trichloro-4-Hydroxyphenyl)Imino]-2,5-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C12H6Cl3NO2
IUPAC Name 4-(2,3,5-trichloro-4-hydroxy-phenyl)iminocyclohexa-2,5-dien-1-one
Molecular Mass 302.541 g·mol−1
Heat of Formation -84.8 ± 16.7 kJ·mol−1
Dipole Moment 1.68 ± 1.08 D
Volume 298.06 Å 3
Surface Area 269.01 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 2,3,6-trichloroindophenol
  • 2,5-cyclohexadien-1-one, 2-chloro-4-((3,5-dichloro-4-hydroxyphenyl)imino)-
  • 4-(2,3,5-trichloro-4-hydroxyphenyl)imino-1-cyclohexa-2,5-dienone
  • tcip
CAS Number(s)
  • 95071-33-3
  • 6038-83-1
InChIKey QTAZYNKIJHHMCG-UHFFFAOYSA-N
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Elements H C N O Cl