4-Acetyl-1-Methyl-7-(4-Pyridinyl)-5,6,7,8-Tetrahydro-3(2H)-Isoquinolinone
Properties
| Property | Value |
|---|---|
| Formula | C17H18N2O2 |
| IUPAC Name | (7s)-4-acetyl-1-methyl-7-(4-pyridyl)-5,6,7,8-tetrahydroisoquinolin-3-one |
| Molecular Mass | 282.337 g·mol−1 |
| Heat of Formation | -226.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.12 ± 1.08 D |
| Volume | 341.38 Å 3 |
| Surface Area | 300.94 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | -0.58 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NVTWQACIVZHUPA-ZDUSSCGKSA-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 |