7-Chloro-2-Methyl-5-Phenyl-5Lambda~4~-[1,2,4]Triazolo[5,1-C][1,2,4]Benzothiadiazine 5-Oxide
Properties
| Property | Value |
|---|---|
| Formula | C15H11ClN4OS |
| IUPAC Name | (8s)-11-chloro-4-methyl-8-phenyl-8λ6-thia-2,3,5,7-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene 8-oxide |
| Molecular Mass | 330.792 g·mol−1 |
| Heat of Formation | 357.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.97 ± 1.08 D |
| Volume | 346.9 Å 3 |
| Surface Area | 311.49 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | -1.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IWWQUVDLAYAHGI-QFIPXVFZSA-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 |