4-Nitrophenyl β-D-Glucopyranosyl-(1->3)-3-Thio-β-L-Glucopyranosyl-(1->3)-β-L-Allopyranoside
Properties
Property | Value |
---|---|
Formula | C24H35NO17S |
IUPAC Name | 2-[2-[3,5-dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)tetrahydropyran-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]sulfanyl-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 641.596 g·mol−1 |
Heat of Formation | -2657.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.54 ± 1.08 D |
Volume | 685.1 Å 3 |
Surface Area | 542.9 Å 2 |
HOMO Energy | -9.05 ± 0.55 eV |
LUMO Energy | 2.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | VWNONHZCCMYIGR-PQRLTTHHSA-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 |