2-{[(2,6-Diamino-4-Oxo-3,4-Dihydro-8-Quinazolinyl)Methyl]Sulfanyl}-N,N-Dimethylethanaminium
Properties
| Property | Value |
|---|---|
| Formula | C13H20N5OS+ |
| IUPAC Name | 2-[(2,6-diamino-4-oxo-3h-quinazolin-8-yl)methylsulfanyl]ethyl-dimethyl-ammonium |
| Molecular Mass | 294.396 g·mol−1 |
| Heat of Formation | -19.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.12 ± 1.08 D |
| Volume | 351.32 Å 3 |
| Surface Area | 326.49 Å 2 |
| HOMO Energy | -8.12 ± 0.55 eV |
| LUMO Energy | 2.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FDIXHXDLCOSDFY-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |