3,3-Bis(3-Bromo-4-Hydroxyphenyl)-7-Chloro-1H,3H-Benzo[De]Isochromen-1-One

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Properties Simple | Detailed

Formula C24H13Br2ClO4
IUPAC Name 4,4-bis(3-bromo-4-hydroxy-phenyl)-10-chloro-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-2-one
Molecular Mass 560.619 g·mol−1
Heat of Formation -310.4 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 492.71 Å 3
Surface Area 410.58 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 1.37 ± eV
Point Group Symmetry C1
Synonyms
  • 4-chloro-3',3"-dibromophenol-1,8-naphthalein
  • ga9
InChIKey GFGZCXHXQCQRFP-UHFFFAOYSA-N
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Elements H C Br O Cl