3-(1H-Imidazol-5-Yl)-2-Sulfanylpropanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C6H8N2O2S |
| IUPAC Name | (2s)-3-imidazol-3-ium-4-ylium-4-yl-2-sulfanyl-propanoic acid |
| Molecular Mass | 172.205 g·mol−1 |
| Heat of Formation | -271.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.15 ± 1.08 D |
| Volume | 192.74 Å 3 |
| Surface Area | 188.24 Å 2 |
| HOMO Energy | -9.42 ± 0.55 eV |
| LUMO Energy | 2.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XFOMEKQNVWAHBI-YFKPBYRVSA-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 |