4-(5-Chloro-1H,3H-Benzo[De]Isochromen-6-Yl)-6-(Methylsulfanyl)-1,3,5-Triazin-2-Amine
Properties
| Property | Value |
|---|---|
| Formula | C16H13ClN4OS |
| IUPAC Name | 4-(7-chloro-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-8-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine |
| Molecular Mass | 344.819 g·mol−1 |
| Heat of Formation | 143.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.83 ± 1.08 D |
| Volume | 369.04 Å 3 |
| Surface Area | 329.11 Å 2 |
| HOMO Energy | -8.81 ± 0.55 eV |
| LUMO Energy | 2.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FPTCGMGLTQPTGE-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 |