(3Z)-3-(1H-Imidazol-4-Ylmethylene)-5-Methoxy-1,3-Dihydro-2H-Indol-2-One

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Properties Simple | Detailed

Formula C13H11N3O2
IUPAC Name (3z)-3-(2h-imidazol-3-ium-2-ylium-4-ylmethylene)-5-methoxy-indolin-2-one
Molecular Mass 241.245 g·mol−1
Heat of Formation -20.2 ± 16.7 kJ·mol−1
Dipole Moment 6.00 ± 1.08 D
Volume 273.9 Å 3
Surface Area 259.2 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy 1.61 ± eV
Point Group Symmetry Cs
Synonyms
  • (3z)-3-(1h-imidazol-5-ylmethylene)-5-methoxy-1h-indol-2(3h)-one
  • (3z)-3-(3h-imidazol-4-ylmethylene)-5-methoxy-2-indolinone
  • (3z)-3-(3h-imidazol-4-ylmethylene)-5-methoxy-indolin-2-one
  • (3z)-3-(3h-imidazol-4-ylmethylene)-5-methoxy-oxindole
  • 3-[1-(3h-imidazol-4-yl)-meth-(z)-ylidene]-5-methoxy-1,3-dihydro-indol-2-one
  • hsci1_000180
  • k00031
  • su 9516
  • su9
  • su9516
  • su9516; 3-[1-(3h-imidazol-4-yl)-meth-(z)-ylidene]-5-methoxy-1,3-dihydro-indol-2-one
InChIKey QNUKRWAIZMBVCU-WCIBSUBMSA-N
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