(2S)-N~1~-[5-(3-Methyl-2H-Indazol-5-Yl)-1,3,4-Thiadiazol-2-Yl]-3-(4-Methylphenyl)-1,2-Propanediamine
Properties
| Property | Value |
|---|---|
| Formula | C20H22N6S |
| IUPAC Name | (2s)-n1-[5-(3-methylindazol-1-ium-5-yl)-1,3,4-thiadiazol-2-yl]-3-(p-tolyl)propane-1,2-diamine |
| Molecular Mass | 378.494 g·mol−1 |
| Heat of Formation | 495.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.30 ± 1.08 D |
| Volume | 455.29 Å 3 |
| Surface Area | 410.38 Å 2 |
| HOMO Energy | -8.33 ± 0.55 eV |
| LUMO Energy | 0.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RJESZRNJZYVXEA-INIZCTEOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S N |