2-Benzyl-6,7,8,9-Tetrahydro-5H-Pyrimido[4,5-D]Azepine
Properties
| Property | Value |
|---|---|
| Formula | C15H17N3 |
| IUPAC Name | 2-benzyl-6,7,8,9-tetrahydro-5h-pyrimido[4,5-d]azepine |
| Molecular Mass | 239.316 g·mol−1 |
| Heat of Formation | 218.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.99 ± 1.08 D |
| Volume | 301.05 Å 3 |
| Surface Area | 273.71 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | -0.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CZWQBSKNHUVZLI-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 |