2-Ethyl-2-{[4-(Methylamino)-6-(1H-1,2,4-Triazol-1-Yl)-1,3,5-Triazin-2-Yl]Amino}Butanenitrile
Properties
| Property | Value |
|---|---|
| Formula | C12H17N9 |
| IUPAC Name | 2-ethyl-2-[[4-(methylamino)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-yl]amino]butanenitrile |
| Molecular Mass | 287.324 g·mol−1 |
| Heat of Formation | 497.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.50 ± 1.08 D |
| Volume | 348.59 Å 3 |
| Surface Area | 313.7 Å 2 |
| HOMO Energy | -9.75 ± 0.55 eV |
| LUMO Energy | -0.93 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AQTLNSKLZWRJEV-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N |