(1R,9S)-11-(4-Chlorobenzoyl)-7,11-Diazatricyclo[7.3.1.0~2,7~]Trideca-2,4-Dien-6-One
Properties
| Property | Value |
|---|---|
| Formula | C18H17ClN2O2 |
| IUPAC Name | (1r,9s)-11-(4-chlorobenzoyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one |
| Molecular Mass | 328.793 g·mol−1 |
| Heat of Formation | -209.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.66 ± 1.08 D |
| Volume | 371.97 Å 3 |
| Surface Area | 300.05 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | 2.49 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AXGNYHMYSWJJSC-GXTWGEPZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C Cl O N |