1-(β-D-Glucopyranosyl)-4-Phenyl-1H-1,2,3-Triazole
Properties
Property | Value |
---|---|
Formula | C14H17N3O5 |
IUPAC Name | (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-(4-phenyl-2-aza-1-azonia-3-azanidacyclopenta-1,4-dien-1-yl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 307.302 g·mol−1 |
Heat of Formation | -573.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.83 ± 1.08 D |
Volume | 345.88 Å 3 |
Surface Area | 311.8 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | 2.45 ± eV |
Point Group Symmetry | C1 |
InChIKey | SLCZDPXCZLKLKY-RKQHYHRCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |