4-Nitrophenyl (5Xi)-2-Acetamido-2-Deoxy-6-O-Sulfo-β-D-Xylo-Hexopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C14H18N2O11S |
| IUPAC Name | [(2r,3r,4r,5r,6s)-5-acetamido-3,4-dihydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl hydrogen sulfate |
| Molecular Mass | 422.365 g·mol−1 |
| Heat of Formation | -1528.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.76 ± 1.08 D |
| Volume | 434.79 Å 3 |
| Surface Area | 374.03 Å 2 |
| HOMO Energy | -10.00 ± 0.55 eV |
| LUMO Energy | 1.85 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UGJNMWVITHXKNR-VJTDZRGJSA-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 N |