(11R,12S,12Ar,13As)-11,12,12A,13A-Tetrahydronaphtho[4',3',2',1':1,12]Tetrapheno[10,11-B]Oxirene-11,12-Diol

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Formula C24H16O3
IUPAC Name (11r,12s,12ar,13as)-11,12,12a,13a-tetrahydronaphtho[4',3',2',1':1,12]tetrapheno[10,11-b]oxirene-11,12-diol
Molecular Mass 352.382 g·mol−1
Heat of Formation -84.4 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 386.17 Å 3
Surface Area 327.78 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
Synonyms
  • 11,12,12a,13a-tetrahydro- (11alpha,12abeta,13abeta)dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol
  • 11,12-dihydroxy-13,14-epoxy-11,12,13,14-tetrahydrodibenzo(a,l)pyrene
  • dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol, 11,12,12a,13a-tetrahydro- (11alpha,12abeta,13abeta)-
  • dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol, 11,12,12a,13a-tetrahydro-, (11r,12s,12ar,13as)-rel-
  • syn-11,12,12a,13a-tetrahydrodibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol
  • syn-dibenzo(a,l)pyrene diolepoxide
  • syn-dibenzo(a,l)pyrene-11,12-dihydrodiol-13,14-epoxide
CAS Number(s)
  • 153857-28-4
InChIKey CJAMAUFDXDSQLU-NAVOZUGXSA-N
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