(9R,10R)-9,10-Dihydrobenzo[E]Pyrene-9,10-Diol

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Properties Simple | Detailed

Formula C20H14O2
IUPAC Name (9r,10r)-9,10-dihydrobenzo[e]pyrene-9,10-diol
Molecular Mass 286.324 g·mol−1
Heat of Formation -45.4 ± 16.7 kJ·mol−1
Dipole Moment 1.98 ± 1.08 D
Volume 323.35 Å 3
Surface Area 283.57 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy -1.22 ± eV
Point Group Symmetry C1
Synonyms
  • b(e)p 9,10-dihydrodiol
  • benzo(e)pyrene, 9,10-dihydro-9,10-dihydroxy-, (e)-
  • trans-9,10-dihydroxy-9,10-dihydrobenzo(e)pyrene
CAS Number(s)
  • 66788-06-5
InChIKey XECJFZBDCQJWTA-UZLBHIALSA-N
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