3,16-Di-Sec-Butyl-6-Isopropyl-5,8,9-Trimethyldecahydro-2H-Pyrido[1,2-D][1,4,7,10,13,16]Oxapentaazacyclononadecine-1,4,7,10,14,17(3H,11H,16H,19H)-Hexone
Properties
| Property | Value |
|---|---|
| Formula | C31H53N5O7 |
| IUPAC Name | (3r,10s,13s,16s,19s)-13-isopropyl-10,11,14-trimethyl-16-[(1s)-1-methylpropyl]-3-[(1r)-1-methylpropyl]-4-oxa-1,8,11,14,17-pentazabicyclo[17.4.0]tricosane-2,5,9,12,15,18-hexone |
| Molecular Mass | 607.782 g·mol−1 |
| Heat of Formation | -1565.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 0.87 ± 1.08 D |
| Volume | 773.21 Å 3 |
| Surface Area | 529.19 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | 0.95 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZUCXDCRAVWYPSD-KBUNMLHLSA-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 |