Iso-Xanthochymol
Properties
| Property | Value |
|---|---|
| Formula | C38H50O6 |
| IUPAC Name | (1s,3s,9r,11r)-7-(3,4-dihydroxybenzoyl)-4,4,10,10-tetramethyl-3,9,11-tris(3-methylbut-2-enyl)-5-oxatricyclo[7.3.1.01,6]tridec-6-ene-8,13-dione |
| Molecular Mass | 602.800 g·mol−1 |
| Heat of Formation | -1074.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.29 ± 1.08 D |
| Volume | 768.73 Å 3 |
| Surface Area | 541.55 Å 2 |
| HOMO Energy | -8.90 ± 0.55 eV |
| LUMO Energy | -0.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KXTNVBQRLRYVCO-LPSZMIQCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |