Puupehanol
Properties
Property | Value |
---|---|
Formula | C21H30O4 |
IUPAC Name | (4as,6as,10r,11r,12ar,12bs)-10,11-dihydroxy-4,4,6a,12b-tetramethyl-2,3,4a,5,6,10,11,12a-octahydro-1h-benzo[a]xanthen-9-one |
Molecular Mass | 346.461 g·mol−1 |
Heat of Formation | -776.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.92 ± 1.08 D |
Volume | 426.95 Å 3 |
Surface Area | 330.27 Å 2 |
HOMO Energy | -9.42 ± 0.55 eV |
LUMO Energy | -0.75 ± eV |
Point Group Symmetry | C1 |
InChIKey | ATEPQLOVXUBFRA-JAYAMIOFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |