2-{2-[2-(2-{4-[(α-D-Mannopyranosyloxy)Methyl]-1H-1,2,3-Triazol-1-Yl}Ethoxy)Ethoxy]Ethoxy}Ethyl 2-[3,6-Bis(Diethylamino)-9H-Xanthen-9-Yl]Benzoate
Properties
| Property | Value |
|---|---|
| Formula | C45H61N5O12 |
| IUPAC Name | 2-[2-[2-[2-[4-[[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethyl 2-[3,6-bis(diethylamino)-9h-xanthen-9-yl]benzoate |
| Molecular Mass | 863.992 g·mol−1 |
| Heat of Formation | -1692.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.62 ± 1.08 D |
| Volume | 1032.77 Å 3 |
| Surface Area | 865.2 Å 2 |
| HOMO Energy | -7.90 ± 0.55 eV |
| LUMO Energy | -0.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NMXJNHVQXYBXDU-ZOLSBRMLSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |