(1R)-1,5-Anhydro-1-(5-Methyl-1H-Benzimidazol-2-Yl)-L-Glucitol
Properties
Property | Value |
---|---|
Formula | C14H18N2O5 |
IUPAC Name | (2r,3s,4r,5r,6s)-2-(hydroxymethyl)-6-(5-methylbenzimidazol-1-ium-7a-ylium-2-yl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 294.303 g·mol−1 |
Heat of Formation | -778.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.15 ± 1.08 D |
Volume | 333.03 Å 3 |
Surface Area | 302.83 Å 2 |
HOMO Energy | -9.18 ± 0.55 eV |
LUMO Energy | 2.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | XIJZORUYQZBFJK-UJPOAAIJSA-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 |