(3S,6S,9R,12S,19R)-9-Isobutyl-3,12-Diisopropyl-6-Methyl-19-Nonyl-1-Oxa-4,7,10,13,16-Pentaazacyclononadecane-2,5,8,11,14,17-Hexone
Properties
| Property | Value |
|---|---|
| Formula | C33H59N5O7 |
| IUPAC Name | (3r,6s,9r,12s,19s)-9-isobutyl-3,12-diisopropyl-6-methyl-19-nonyl-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone |
| Molecular Mass | 637.851 g·mol−1 |
| Heat of Formation | -1763.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.27 ± 1.08 D |
| Volume | 845.79 Å 3 |
| Surface Area | 640.78 Å 2 |
| HOMO Energy | -9.51 ± 0.55 eV |
| LUMO Energy | 0.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KIJLRIARMCGDJZ-KTJDEMTHSA-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 |