(4E)-4-[Amino(Hydroxyamino)Methylene]-2-Hydroxy-2,5-Cyclohexadien-1-One

Molecule SVG Image

Properties Simple | Detailed

Formula C7H8N2O3
IUPAC Name (4e)-4-[amino-(hydroxyamino)methylene]-2-hydroxy-cyclohexa-2,5-dien-1-one
Molecular Mass 168.150 g·mol−1
Heat of Formation -204.5 ± 16.7 kJ·mol−1
Dipole Moment 9.16 ± 1.08 D
Volume 186.89 Å 3
Surface Area 188.01 Å 2
HOMO Energy -8.10 ± 0.55 eV
LUMO Energy -1.24 ± eV
Point Group Symmetry C1
Synonyms
  • (4e)-4-[amino-(hydroxyamino)methylene]-2-hydroxy-1-cyclohexa-2,5-dienone
  • (4e)-4-[amino-(hydroxyamino)methylene]-2-hydroxy-cyclohexa-2,5-dien-1-one
  • (4e)-4-[amino-(hydroxyamino)methylidene]-2-hydroxy-cyclohexa-2,5-dien-1-one
  • (4e)-4-[amino-(hydroxyamino)methylidene]-2-hydroxycyclohexa-2,5-dien-1-one
  • benzenecarboximidamide, n,3,4-trihydroxy-
  • n,3,4-trihydroxybenzenecarboximidamide
  • vf 236
CAS Number(s)
  • 95933-72-5
  • 125199-74-8
InChIKey UYRMXZIBPZVBNO-QPJJXVBHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N