1-S-[(1E)-5-(Methylsulfinyl)-N-(Sulfooxy)Pentanimidoyl]-1-Thio-β-D-Glucopyranose
Properties
Property | Value |
---|---|
Formula | C12H23NO10S3 |
IUPAC Name | [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1e)-5-[(r)-methylsulfinyl]-n-sulfooxy-pentanimidothioate |
Molecular Mass | 437.507 g·mol−1 |
Heat of Formation | -1706.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.77 ± 1.08 D |
Volume | 454.54 Å 3 |
Surface Area | 353.57 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -0.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | GMMLNKINDDUDCF-JRWRFYLSSA-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 |