[1-(1,1-Dioxido-3-Oxo-2,3-Dihydro-1,2-Benzothiazol-6-Yl)-1H-1,2,3-Triazol-4-Yl]Methyl β-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C16H18N4O9S |
| IUPAC Name | 1,1-dioxo-6-[4-[[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]triazol-1-yl]-1,2-benzothiazol-3-one |
| Molecular Mass | 442.401 g·mol−1 |
| Heat of Formation | -1221.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.14 ± 1.08 D |
| Volume | 448.51 Å 3 |
| Surface Area | 376.16 Å 2 |
| HOMO Energy | -10.13 ± 0.55 eV |
| LUMO Energy | 0.94 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CUFOYUJLNJPOJR-HSMHQDCBSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |