10-Bromo-11B-(2-Fluorophenyl)-2,3,7,11B-Tetrahydrooxazolo[3,2-D][1,4]Benzodiazepin-6(5H)-One
Properties
| Property | Value |
|---|---|
| Formula | C17H14BrFN2O2 |
| IUPAC Name | (4r,11br)-10-bromo-11b-(2-fluorophenyl)-2,3,5,7-tetrahydrooxazolo[3,2-d][1,4]benzodiazepin-6-one |
| Molecular Mass | 377.208 g·mol−1 |
| Heat of Formation | -260.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 0.75 ± 1.08 D |
| Volume | 362.39 Å 3 |
| Surface Area | 306.76 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | 2.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XDKCGKQHVBOOHC-KRWDZBQOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N Br |