Pyochelin I
Properties
| Property | Value |
|---|---|
| Formula | C14H16N2O3S2 |
| IUPAC Name | (2r,3r,4r)-2-[(4r)-2-(2-hydroxyphenyl)-4,5-dihydrothiazol-4-yl]-3-methyl-thiazolidine-4-carboxylic acid |
| Molecular Mass | 324.418 g·mol−1 |
| Heat of Formation | -334.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.04 ± 1.08 D |
| Volume | 360.55 Å 3 |
| Surface Area | 309.61 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | 2.17 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NYBZAGXTZXPYND-GBIKHYSHSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |