6-(Disulfanylmethylene)-2,4-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C7H6OS2
IUPAC Name 6-[bis(sulfanyl)methylene]cyclohexa-2,4-dien-1-one
Molecular Mass 170.252 g·mol−1
Heat of Formation 66.5 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 186.71 Å 3
Surface Area 182.0 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.93 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxybenzenecarbodithioic acid
  • 2-hydroxydithiobenzoic acid
  • 6-(bis-sulfanylmethylene)cyclohexa-2,4-dien-1-one
  • 6-(bis-sulfanylmethylidene)cyclohexa-2,4-dien-1-one
  • 6-(dimercaptomethylene)-1-cyclohexa-2,4-dienone
  • 6-(dimercaptomethylene)cyclohexa-2,4-dien-1-one
  • benzenecarbodithioic acid, 2-hydroxy-
  • benzenecarbodithioic acid, 2-hydroxy- (9ci)
  • dithiosalicylic acid
  • salicylic acid, dithio-
  • salicylic acid, dithio- (8ci)
CAS Number(s)
  • 527-89-9
InChIKey XMOPRHWBMPXIEU-UHFFFAOYSA-N
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