N-[(5R,6R,7R,8S)-6,7-Dihydroxy-5-(Hydroxymethyl)-2-(2-Phenylethyl)-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyridin-8-Yl]-3-Sulfanylpropanamide
Properties
| Property | Value |
|---|---|
| Formula | C19H25N3O4S |
| IUPAC Name | n-[(5r,6r,7r,8s)-6,7-dihydroxy-5-(hydroxymethyl)-2-(2-phenylethyl)-5,6,7,8-tetrahydro-3h-imidazo[1,2-a]pyridin-4-ium-3-ylium-8-yl]-3-sulfanyl-propanamide |
| Molecular Mass | 391.485 g·mol−1 |
| Heat of Formation | -583.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.66 ± 1.08 D |
| Volume | 457.83 Å 3 |
| Surface Area | 405.86 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | 2.41 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZEEDRHPJCAOZKV-VDHUWJSZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |