1-[(2S,6R,14R,22R,25R)-15-Methyl-25-(2-Methyl-1-Propen-1-Yl)-1,3,13,15-Tetraazaheptacyclo[18.4.1.0~2,6~.0~6,22~.0~7,12~.0~14,22~.0~16,21~]Pentacosa-7,9,11,16,18,20-Hexaen-3-Yl]Ethanone
Properties
| Property | Value |
|---|---|
| Formula | C28H32N4O |
| IUPAC Name | 1-[(2s,6r,14r,22r,25r)-15-methyl-25-(2-methyl-1-propen-1-yl)-1,3,13,15-tetraazaheptacyclo[18.4.1.0 2,6 .0 6,22 .0 7,12 .0 14,22 .0 16,21 ]pentacosa-7,9,11,16,18,20-hexaen-3-yl]ethanone |
| Molecular Mass | 440.580 g·mol−1 |
| Heat of Formation | 75.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.67 ± 1.08 D |
| Volume | 528.07 Å 3 |
| Surface Area | 393.48 Å 2 |
| HOMO Energy | -8.08 ± 0.55 eV |
| LUMO Energy | 3.34 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AJKLOOXVDIANRY-MGDFUXISSA-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 |