2-Chloro-4-[3-(3-Chloro-4-Hydroxyphenyl)-1,1-Dioxido-3H-2,1-Benzoxathiol-3-Yl]Phenyl β-D-Galactopyranoside
Properties
Property | Value |
---|---|
Formula | C25H22Cl2O10S |
IUPAC Name | (2s,3r,4s,5r,6r)-2-[2-chloro-4-[(3s)-3-(3-chloro-4-hydroxyphenyl)-1,1-dioxo-2,1$l^{6}-benzoxathiol-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
Molecular Mass | 585.407 g·mol−1 |
Heat of Formation | 1346.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 30.11 ± 1.08 D |
Volume | 534.23 Å 3 |
Surface Area | 442.58 Å 2 |
HOMO Energy | -7.12 ± 0.55 eV |
LUMO Energy | -2.28 ± eV |
Point Group Symmetry | C1 |
InChIKey | UYYRDZGZGNYVBA-HCRCWBKNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | S C O Cl |