[(4R,7S,8S)-7-Hydroxy-4-Oxido-5,6,7,8-Tetrahydro-3H-Pyrrolizin-4-Ium-1-Yl]Methyl (2R,3R)-2-Hydroxy-2-Isopropyl-3-Methoxy-Butanoate
Properties
| Property | Value |
|---|---|
| Formula | C16H28NO6+ |
| IUPAC Name | [(4r,7s,8s)-4,7-dihydroxy-5,6,7,8-tetrahydro-3h-pyrrolizin-4-ium-1-yl]methyl (2r,3r)-2-hydroxy-2-isopropyl-3-methoxy-butanoate |
| Molecular Mass | 330.397 g·mol−1 |
| Heat of Formation | -927.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.86 ± 1.08 D |
| Volume | 406.22 Å 3 |
| Surface Area | 325.5 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | 0.17 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DGIRBLHVRQGKOR-VJOHVRBBSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |