Neraval
Properties
| Property | Value |
|---|---|
| Formula | C12H20N2O2S2 |
| IUPAC Name | 5-[(1r)-1-methylbutyl]-5-(2-methylsulfanylethyl)-2-thioxo-hexahydropyrimidine-4,6-dione |
| Molecular Mass | 288.429 g·mol−1 |
| Heat of Formation | -405.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.45 ± 1.08 D |
| Volume | 349.57 Å 3 |
| Surface Area | 302.6 Å 2 |
| HOMO Energy | -8.61 ± 0.55 eV |
| LUMO Energy | -1.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KEMCRVSPPRNENL-MRVPVSSYSA-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 |