(6E)-6-(3-Oxo-1,3-Dihydro-2H-Indol-2-Ylidene)Indolo[2,1-B]Quinazolin-12(6H)-One

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Properties Simple | Detailed

Formula C23H13N3O2+
IUPAC Name (6e)-6-(3-oxoindolin-2-ylidene)indolo[2,1-b]quinazolin-11-ium-12-one
Molecular Mass 363.368 g·mol−1
Heat of Formation 261.5 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 393.11 Å 3
Surface Area 350.67 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -1.67 ± eV
Point Group Symmetry Cs
Synonyms
  • (6e)-6-(3-ketoindolin-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • (6e)-6-(3-oxo-1h-indol-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • (6e)-6-(3-oxo-2-indolinylidene)-12-indolo[2,1-b]quinazolinone
  • (6e)-6-(3-oxoindolin-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • 6-(3-ketoindolin-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • 6-(3-oxo-1h-indol-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • 6-(3-oxo-2-indolinylidene)-12-indolo[2,1-b]quinazolinone
  • 6-(3-oxoindolin-2-ylidene)indolo[2,1-b]quinazolin-12-one
  • indolo(2,1-b)quinazolin-12(6h)-one, 6-(1,3-dihydro-3-oxo-2h-indol-2-ylidene)-
CAS Number(s)
  • 97457-31-3
InChIKey DXENDDMPDZMHSQ-FMQUCBEESA-N
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