(9S,10R,13R,14E,21R)-8-Acetyl-13,16-Dimethyl-12-Oxa-8,16-Diazapentacyclo[8.8.3.0~1,9~.0~2,7~.0~14,21~]Henicosa-2,4,6,14-Tetraen-19-One
Properties
| Property | Value |
|---|---|
| Formula | C22H26N2O3 |
| IUPAC Name | (9s,10r,13r,14e,21r)-8-acetyl-13,16-dimethyl-12-oxa-8,16-diazapentacyclo[8.8.3.0 1,9 .0 2,7 .0 14,21 ]henicosa-2,4,6,14-tetraen-19-one |
| Molecular Mass | 366.453 g·mol−1 |
| Heat of Formation | -328.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.76 ± 1.08 D |
| Volume | 429.24 Å 3 |
| Surface Area | 338.17 Å 2 |
| HOMO Energy | -8.57 ± 0.55 eV |
| LUMO Energy | -0.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XZIACDKZDCVKKQ-XBJDSYLLSA-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 |