(1R,3R,9S,11S)-7-(3,4-Dihydroxybenzoyl)-4,4,10,10-Tetramethyl-3,9,11-Tris(3-Methyl-2-Buten-1-Yl)-5-Oxatricyclo[7.3.1.0~1,6~]Tridec-6-Ene-8,13-Dione

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Formula C38H50O6
IUPAC Name (1r,3r,9s,11s)-7-(3,4-dihydroxybenzoyl)-4,4,10,10-tetramethyl-3,9,11-tris(3-methyl-2-buten-1-yl)-5-oxatricyclo[7.3.1.0 1,6 ]tridec-6-ene-8,13-dione
Molecular Mass 602.800 g·mol−1
Heat of Formation -1084.6 ± 16.7 kJ·mol−1
Dipole Moment 6.39 ± 1.08 D
Volume 770.15 Å 3
Surface Area 515.83 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy 2.67 ± eV
Point Group Symmetry C1
InChIKey KXTNVBQRLRYVCO-MWVHARJDSA-N
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