(1S,2R,5S,6R,7R,9S)-6-(Hydroxymethyl)-5,12-Dimethyl-4-Oxa-12-Azatricyclo[7.2.1.0~2,7~]Dodecan-10-One
Properties
| Property | Value |
|---|---|
| Formula | C13H21NO3 |
| IUPAC Name | (1s,2r,5s,6r,7r,9s)-6-(hydroxymethyl)-5,12-dimethyl-4-oxa-12-azatricyclo[7.2.1.02,7]dodecan-10-one |
| Molecular Mass | 239.311 g·mol−1 |
| Heat of Formation | -547.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.31 ± 1.08 D |
| Volume | 295.61 Å 3 |
| Surface Area | 252.32 Å 2 |
| HOMO Energy | -9.17 ± 0.55 eV |
| LUMO Energy | 3.83 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JXWVFTVEPDABMO-URIQBSJHSA-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 |