(1Ar,2R,3S,11Cs)-1A,2,3,6,7,11C-Hexahydrocyclopenta[7,8]Tetrapheno[1,2-B]Oxirene-2,3-Diol

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Formula C20H16O3
IUPAC Name (1ar,2r,3s,11cs)-1a,2,3,6,7,11c-hexahydrocyclopenta[7,8]tetrapheno[1,2-b]oxirene-2,3-diol
Molecular Mass 304.339 g·mol−1
Heat of Formation -150.5 ± 16.7 kJ·mol−1
Dipole Moment 4.20 ± 1.08 D
Volume 339.0 Å 3
Surface Area 300.99 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy -1.24 ± eV
Point Group Symmetry C1
Synonyms
  • cholanthrene-9,10-diol-7,8-epoxide
  • indeno(7',1':6,7,8)phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,6,7,11c-hexahydro-, (1aalpha,2beta,3alpha,11calpha)- (+-)-
CAS Number(s)
  • 111238-25-6
  • 119181-09-8
InChIKey BQXVUFNOKKHIKA-ZGXWSNOMSA-N
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