1-S-[(1Z)-2-(1H-Indol-3-Yl)-N-(Sulfooxy)Ethanimidoyl]-1-Thio-β-D-Glucopyranose
Properties
Property | Value |
---|---|
Formula | C16H20N2O9S2 |
IUPAC Name | [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1z)-2-(1h-indol-3-yl)-n-sulfooxy-ethanimidothioate |
Molecular Mass | 448.468 g·mol−1 |
Heat of Formation | -1310.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.55 ± 1.08 D |
Volume | 465.41 Å 3 |
Surface Area | 345.51 Å 2 |
HOMO Energy | -8.57 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | DNDNWOWHUWNBCK-PIAXYHQTSA-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 |