(1R,9S,10R)-17-Allyl-4-Hydroxy-17-Thioniatetracyclo[7.5.3.0~1,10~.0~2,7~]Heptadeca-2,4,6-Triene
Properties
Property | Value |
---|---|
Formula | C19H25OS+ |
IUPAC Name | (1r,9s,10r)-17-allyl-17-thioniatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol |
Molecular Mass | 301.466 g·mol−1 |
Heat of Formation | 2694.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.85 ± 1.08 D |
Volume | 325.0 Å 3 |
Surface Area | 286.7 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | -2.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | GIOLDLCQWZJHCJ-SFFNPBHPSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | S C O |