3,3-Bis-(4-Hydroxy-Phenyl)-6-Nitro-3H-Benzo[De]Isochromen-1-One

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Properties Simple | Detailed

Formula C24H15NO6
IUPAC Name 3,3-bis-(4-hydroxy-phenyl)-6-nitro-3h-benzo[de]isochromen-1-one
Molecular Mass 413.379 g·mol−1
Heat of Formation -319.5 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 448.43 Å 3
Surface Area 374.64 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 1.01 ± eV
Point Group Symmetry C1
Synonyms
  • 3-diphenol-6-nitro-3h-benzo[de]isochromen-1-one
  • mr2
  • mr20
InChIKey FLWABCQDXUKNQY-UHFFFAOYSA-N
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