(5Ar,5Br,10Br,10Cr)-5,6-Dioxo-5,5A,5B,6-Tetrahydroindeno[2',1':3,4]Cyclobuta[1,2-A]Indene-10B,10C-Diyl Diacetate

Molecule SVG Image

Properties Simple | Detailed

Formula C22H16O6
IUPAC Name (5ar,5br,10br,10cr)-5,6-dioxo-5,5a,5b,6-tetrahydroindeno[2',1':3,4]cyclobuta[1,2-a]indene-10b,10c-diyl diacetate
Molecular Mass 376.359 g·mol−1
Heat of Formation -713.8 ± 16.7 kJ·mol−1
Dipole Moment 8.56 ± 1.08 D
Volume 426.04 Å 3
Surface Area 337.9 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C2
Synonyms
  • 4b,4c-bis(acetyloxy)-4b,4c,9a,9b-tetrahydrocyclobuta(1,2-a:4,3-a')diindene-9,10-dione (4balpha,4cbeta,9abeta,9calpha)-
  • 9,10-dioxoindano(2',3'-4,3)cyclobuta(1,2-b)indan-4b,4c-diyl diacetate
  • cyclobuta(1,2-a:4,3-a')diindene-9,10-dione, 4b,4c-bis(acetyloxy)-4b,4c,9a,9b-tetrahydro-, (4balpha,4cbeta,9abeta,9calpha)-
  • dcid
CAS Number(s)
  • 130817-81-1
InChIKey MGKJFRPUFVNFPI-GPHNJDIKSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O