Methyl 5,11-Diisopropenyl-14-Oxo-3,13,16-Trioxatetracyclo[10.2.1.1~7,10~.0~2,4~]Hexadeca-1(15),7,9-Triene-8-Carboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C21H22O6
IUPAC Name methyl (2s,4s,5r,11r,12r)-5,11-diisopropenyl-14-oxo-3,13,16-trioxatetracyclo[10.2.1.1 7,10 .0 2,4 ]hexadeca-1(15),7,9-triene-8-carboxylate
Molecular Mass 370.396 g·mol−1
Heat of Formation -629.3 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 434.11 Å 3
Surface Area 350.02 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
InChIKey HGJODUIUVPXWLZ-KJHZQCITSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O