(3Ar,5R,6S,7R,7Ar)-2-(Ethylamino)-5-(Hydroxymethyl)-5,6,7,7A-Tetrahydro-3Ah-Pyrano[3,2-D][1,3]Thiazole-6,7-Diol
Properties
Property | Value |
---|---|
Formula | C9H16N2O4S |
IUPAC Name | (3ar,5r,6s,7r,7ar)-2-(ethylamino)-5-(hydroxymethyl)-5,6,7,7a-tetrahydro-3ah-pyrano[3,2-d]thiazole-6,7-diol |
Molecular Mass | 248.299 g·mol−1 |
Heat of Formation | -670.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.19 ± 1.08 D |
Volume | 278.08 Å 3 |
Surface Area | 251.74 Å 2 |
HOMO Energy | -9.18 ± 0.55 eV |
LUMO Energy | 2.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | PPAIMZHKIXDJRN-FMDGEEDCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |