N-{[(2E)-2-(3-Bromobenzylidene)Hydrazino]Carbonothioyl}-β-D-Glucopyranosylamine
Properties
| Property | Value |
|---|---|
| Formula | C14H18BrN3O5S |
| IUPAC Name | 1-[(e)-(3-bromophenyl)methyleneamino]-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea |
| Molecular Mass | 420.279 g·mol−1 |
| Heat of Formation | -617.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.25 ± 1.08 D |
| Volume | 420.78 Å 3 |
| Surface Area | 376.3 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | -1.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PGBHKZPXJWINSR-QCOQDYPWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N S Br |