5,5-Diethyl-1-(β-D-Glucopyranosyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione
Properties
Property | Value |
---|---|
Formula | C14H22N2O8 |
IUPAC Name | 5,5-diethyl-1-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]hexahydropyrimidine-2,4,6-trione |
Molecular Mass | 346.333 g·mol−1 |
Heat of Formation | -1553.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.88 ± 1.08 D |
Volume | 392.75 Å 3 |
Surface Area | 312.44 Å 2 |
HOMO Energy | -10.24 ± 0.55 eV |
LUMO Energy | 2.71 ± eV |
Point Group Symmetry | C1 |
InChIKey | ALDUFTZQPLCBID-VVULQXIFSA-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 |