2-[(2R)-4-[(4-Hydroxyphenyl)Methyl]-2-[2-(4H-Imidazol-3-Ium-4-Ylium-5-Yl)Ethyl]-5-Oxo-2H-Imidazol-1-Yl]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H18N4O4 |
| IUPAC Name | 2-[(2r)-4-[(4-hydroxyphenyl)methyl]-2-[2-(1h-imidazol-4-yl)ethyl]-5-oxo-2h-imidazol-1-yl]acetic acid |
| Molecular Mass | 342.349 g·mol−1 |
| Heat of Formation | -394.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.40 ± 1.08 D |
| Volume | 403.25 Å 3 |
| Surface Area | 353.15 Å 2 |
| HOMO Energy | -8.98 ± 0.55 eV |
| LUMO Energy | -0.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JWVFUFONFHIVNM-OAHLLOKOSA-N |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |