3-Oxa-9-Azatricyclo[3.3.1.0~2,4~]Non-7-Yl Tropate
Properties
| Property | Value |
|---|---|
| Formula | C16H19NO4 |
| IUPAC Name | [(1r,2r,4s,5s)-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2s)-3-hydroxy-2-phenyl-propanoate |
| Molecular Mass | 289.326 g·mol−1 |
| Heat of Formation | -439.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.29 ± 1.08 D |
| Volume | 340.61 Å 3 |
| Surface Area | 303.83 Å 2 |
| HOMO Energy | -9.48 ± 0.55 eV |
| LUMO Energy | -0.04 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MOYZEMOPQDTDHA-JSLGZRHDSA-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 |