4-[(2R,6S)-3,5-Dioxo-4-Azatricyclo[5.2.1.0~2,6~]Dec-8-En-4-Yl]-N-(4-Methyl-8-Quinolinyl)Benzamide
Properties
| Property | Value |
|---|---|
| Formula | C26H21N3O3 |
| IUPAC Name | 4-[(1r,2s,6r,7s)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-n-(4-methyl-8-quinolyl)benzamide |
| Molecular Mass | 423.463 g·mol−1 |
| Heat of Formation | -79.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.30 ± 1.08 D |
| Volume | 479.56 Å 3 |
| Surface Area | 415.52 Å 2 |
| HOMO Energy | -8.43 ± 0.55 eV |
| LUMO Energy | 2.29 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BLPUCTSDPCUHQQ-NEAWWFDSSA-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 |