(2E)-5-(2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl)-2-Pentenoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C10H14N2O3S |
| IUPAC Name | (e)-5-[(3ar,4s,6as)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pent-2-enoic acid |
| Molecular Mass | 242.295 g·mol−1 |
| Heat of Formation | -501.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.69 ± 1.08 D |
| Volume | 278.54 Å 3 |
| Surface Area | 263.09 Å 2 |
| HOMO Energy | -9.16 ± 0.55 eV |
| LUMO Energy | -0.63 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NZERRTYPTPRCIR-IVXSBKHASA-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 |