4-{[4-Amino-6-(5-Chloro-1H,3H-Benzo[De]Isochromen-6-Yl)-1,3,5-Triazin-2-Yl]Sulfanyl}Butanamide
Properties
| Property | Value |
|---|---|
| Formula | C19H18ClN5O2S |
| IUPAC Name | 4-{[4-amino-6-(5-chloro-1h,3h-benzo[de]isochromen-6-yl)-1,3,5-triazin-2-yl]sulfanyl}butanamide |
| Molecular Mass | 415.897 g·mol−1 |
| Heat of Formation | -79.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.23 ± 1.08 D |
| Volume | 453.84 Å 3 |
| Surface Area | 405.28 Å 2 |
| HOMO Energy | -8.88 ± 0.55 eV |
| LUMO Energy | 1.99 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VIGHQZSTZWNWFA-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |