N~3~-Carbamoyl-N-(2-Methyl-1,3-Benzothiazol-6-Yl)-β-Alaninamide
Properties
| Property | Value |
|---|---|
| Formula | C12H14N4O2S |
| IUPAC Name | n-(2-methyl-1,3-benzothiazol-6-yl)-3-ureido-propanamide |
| Molecular Mass | 278.330 g·mol−1 |
| Heat of Formation | -229.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.76 ± 1.08 D |
| Volume | 313.62 Å 3 |
| Surface Area | 300.79 Å 2 |
| HOMO Energy | -8.73 ± 0.55 eV |
| LUMO Energy | 2.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OVXHZNUBLPBIEB-UHFFFAOYSA-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 |