4-{2-[4-(Hydroxymethyl)-1H-1,2,3-Triazol-1-Yl]Ethyl}Phenyl α-D-Mannopyranoside
Properties
Property | Value |
---|---|
Formula | C17H23N3O7 |
IUPAC Name | (2r,3s,4s,5s,6r)-2-(hydroxymethyl)-6-[4-[2-[4-(hydroxymethyl)triazol-1-yl]ethyl]phenoxy]tetrahydropyran-3,4,5-triol |
Molecular Mass | 381.380 g·mol−1 |
Heat of Formation | -980.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.85 ± 1.08 D |
Volume | 439.4 Å 3 |
Surface Area | 377.44 Å 2 |
HOMO Energy | -9.43 ± 0.55 eV |
LUMO Energy | 2.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | BCFCTVRYNLVCND-NRKLIOEPSA-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 |