(6S,6As,8S,10R,10As)-6-Ethyl-2-Hydroxy-6A,8,10-Trimethyl-2,6,6A,7,8,9,10,10A-Octahydro-1H-Isochromeno[4,3-C]Pyridin-1-One
Properties
Property | Value |
---|---|
Formula | C17H25NO3 |
IUPAC Name | (6s,6as,8s,10r,10as)-6-ethyl-2-hydroxy-6a,8,10-trimethyl-6,7,8,9,10,10a-hexahydroisochromeno[4,3-c]pyridin-1-one |
Molecular Mass | 291.385 g·mol−1 |
Heat of Formation | -471.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.15 ± 1.08 D |
Volume | 356.61 Å 3 |
Surface Area | 294.66 Å 2 |
HOMO Energy | -8.78 ± 0.55 eV |
LUMO Energy | -0.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | KRTBGHXNQMTBCL-FHSYMAMWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |