5-[2-(Cyclohexylamino)-4-Pyridyl]-4-(2-Naphthyl)-2-Tetrahydropyran-4-Yl-1,2,4-Triazol-3-One
Properties
| Property | Value |
|---|---|
| Formula | C28H31N5O2 |
| IUPAC Name | 5-[2-(cyclohexylamino)-4-pyridyl]-4-(2-naphthyl)-2-tetrahydropyran-4-yl-1,2,4-triazole-2,4-diium-3-one |
| Molecular Mass | 469.578 g·mol−1 |
| Heat of Formation | 27.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.54 ± 1.08 D |
| Volume | 572.59 Å 3 |
| Surface Area | 471.9 Å 2 |
| HOMO Energy | -8.68 ± 0.55 eV |
| LUMO Energy | 2.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YZJYYYWPZRYBLV-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |