(2'R,3R,4R,9'E,11'R,13'E,15'Z)-4,11'-Dihydroxy-2',4,9'-Trimethyl-4'H,5H,12'H-Spiro[1,2-Dithiolane-3,6'-[19]Thia[3,20]Diazabicyclo[15.2.1]Icosa[1(20),9,13,15,17]Pentaene]-4',5,12'-Trione
Properties
| Property | Value |
|---|---|
| Formula | C22H26N2O5S3 |
| IUPAC Name | (2r,4'r,6r,9e,11r,13e,15z)-4',11-dihydroxy-2,4',9-trimethyl-spiro[19-thia-3,20-diazabicyclo[15.2.1]icosa-1(20),9,13,15,17-pentaene-6,5'-dithiolane]-3',4,12-trione |
| Molecular Mass | 494.647 g·mol−1 |
| Heat of Formation | -575.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.52 ± 1.08 D |
| Volume | 566.68 Å 3 |
| Surface Area | 408.39 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | 1.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LBSJFNZGEMTYDO-WVOOBQOBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |