1-Methoxy-3-(2-Nitro-1H-Imidazol-1-Yl)-2-Propanyl β-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C13H19N3O10 |
| IUPAC Name | (2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(1r)-1-(methoxymethyl)-2-(2-nitroimidazol-1-yl)ethoxy]tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 377.304 g·mol−1 |
| Heat of Formation | -1232.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.54 ± 1.08 D |
| Volume | 407.76 Å 3 |
| Surface Area | 349.34 Å 2 |
| HOMO Energy | -10.20 ± 0.55 eV |
| LUMO Energy | -0.87 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AGTMQQNYEJNPKI-URKRFGABSA-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 |