3,3'-{1,9-Nonanediylbis[(3S)-3-Ethyl-1,3-Azepanediyl]}Diphenol
Properties
| Property | Value |
|---|---|
| Formula | C37H58N2O2 |
| IUPAC Name | 3-[(1r,3s)-3-ethyl-1-[9-[(1s,3r)-3-ethyl-3-(3-hydroxyphenyl)azepan-1-yl]nonyl]azepan-3-yl]phenol |
| Molecular Mass | 562.869 g·mol−1 |
| Heat of Formation | -419.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.67 ± 1.08 D |
| Volume | 759.09 Å 3 |
| Surface Area | 630.25 Å 2 |
| HOMO Energy | -8.50 ± 0.55 eV |
| LUMO Energy | 3.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZZKZUUMHRSWLQQ-JXLNJXQWSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |