(−)-Pelorol

Molecule SVG Image

Properties Simple | Detailed

Formula C23H32O4
IUPAC Name methyl (4as,6ar,11ar,11bs)-9,10-dihydroxy-4,4,6a,11b-tetramethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[a]fluorene-7-carboxylate
Molecular Mass 372.498 g·mol−1
Heat of Formation -794.6 ± 16.7 kJ·mol−1
Dipole Moment 1.57 ± 1.08 D
Volume 459.5 Å 3
Surface Area 360.6 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • (4as,6ar,11ar,11bs)-9,10-dihydroxy-4,4,6a,11b-tetramethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[i]fluorene-7-carboxylic acid methyl ester
  • methyl (4as,6ar,11ar,11bs)-9,10-dihydroxy-4,4,6a,11b-tetramethyl-1,2,3,4a,5,6,11,11a-octahydrobenzo[i]fluorene-7-carboxylate
InChIKey FFBLMLRQAKGTJN-VQDLLJBESA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O