6-[4-Chloro-2-(2-Furylmethylamino)-5-Sulfamoyl-Benzoyl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C18H19ClN2O11S |
IUPAC Name | (2r,3s,4s,5s,6s)-6-[4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
Molecular Mass | 506.868 g·mol−1 |
Heat of Formation | -1780.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.47 ± 1.08 D |
Volume | 515.52 Å 3 |
Surface Area | 407.03 Å 2 |
HOMO Energy | -9.44 ± 0.55 eV |
LUMO Energy | -1.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | RNVHHPUYELVHRE-IBTNMTNLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H O N S |