(3S,4S)-1,2,3,4-Tetrahydrobenzo[K]Tetraphene-3,4-Diol

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Properties Simple | Detailed

Formula C22H18O2
IUPAC Name (3s,4s)-1,2,3,4-tetrahydronaphtho[2,1-h]phenanthrene-3,4-diol
Molecular Mass 314.377 g·mol−1
Heat of Formation -111.5 ± 16.7 kJ·mol−1
Dipole Moment 2.10 ± 1.08 D
Volume 362.93 Å 3
Surface Area 323.68 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry C1
Synonyms
  • (10s,11s)-8,9,10,11-tetrahydronaphtho[5,6-b]phenanthrene-10,11-diol
  • dibenz(a,h)anthracene, 1,2,3,4-tetrahydro-3,4-dihydroxy-, (e)-
  • trans-3,4-dihydroxy-1,2,3,4-tetrahydrodibenz(a,h)anthracene
  • trans-3,4-dihydroxy-1,2,3,4-tetrahydrodibenzo(a,h)anthracene
CAS Number(s)
  • 70443-38-8
InChIKey MUKIATZFWSBOHR-VXKWHMMOSA-N
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