1-Deoxy-1-{[4-(Hydroxymethyl)Benzyl](Sulfanylcarbonothioyl)Amino}-D-Glucitol
Properties
Property | Value |
---|---|
Formula | C15H23NO6S2 |
IUPAC Name | [4-(hydroxymethyl)phenyl]methyl-[(2r,3r,4r,5r)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid |
Molecular Mass | 377.476 g·mol−1 |
Heat of Formation | -982.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.46 ± 1.08 D |
Volume | 430.12 Å 3 |
Surface Area | 349.55 Å 2 |
HOMO Energy | -8.56 ± 0.55 eV |
LUMO Energy | -1.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | XAMXFGPRNKOPIS-AAVRWANBSA-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 |