4-{[Hydroxy(2-Methyl-2-Propanyl)Amino]Methylene}-2,5-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C11H15NO2+
IUPAC Name 4-[[tert-butyl(hydroxy)amino]methylene]cyclohexa-2,5-dien-1-one
Molecular Mass 193.242 g·mol−1
Heat of Formation -107.7 ± 16.7 kJ·mol−1
Dipole Moment 7.85 ± 1.08 D
Volume 249.6 Å 3
Surface Area 230.68 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 1.88 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(tert-butyl-hydroxy-amino)methylene]cyclohexa-2,5-dien-1-one
  • 4-[(tert-butyl-hydroxy-amino)methylidene]cyclohexa-2,5-dien-1-one
  • 4-[(tert-butyl-hydroxyamino)methylene]-1-cyclohexa-2,5-dienone
  • 4-[(tert-butyl-hydroxyamino)methylidene]cyclohexa-2,5-dien-1-one
InChIKey AEWRZTGDOHHFFT-UHFFFAOYSA-N
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