(4S,5Ar)-2,5A-Dimethyl-4-Sulfanyl-5,5A,6,7,10,11-Hexahydro-4H-[1]Benzofuro[4,5-H]Isochromen-6-Ol
Properties
Property | Value |
---|---|
Formula | C17H20O3S |
IUPAC Name | (4s,5ar,6s)-2,5a-dimethyl-4-sulfanyl-4,5,6,7,10,11-hexahydrobenzofuro[4,5-h]isochromen-6-ol |
Molecular Mass | 304.404 g·mol−1 |
Heat of Formation | -367.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.52 ± 1.08 D |
Volume | 351.05 Å 3 |
Surface Area | 297.68 Å 2 |
HOMO Energy | -8.03 ± 0.55 eV |
LUMO Energy | -0.24 ± eV |
Point Group Symmetry | C1 |
InChIKey | UDFSTCOCQJDTJG-ZMSDIMECSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O |