3-(1H-Benzimidazol-2-Yl)-N-(2-Methyl-3-Furoyl)-D-Alanine
Properties
| Property | Value |
|---|---|
| Formula | C16H15N3O4 |
| IUPAC Name | (2r)-3-(1h-benzimidazol-2-yl)-2-[(2-methylfuran-3-carbonyl)amino]propanoic acid |
| Molecular Mass | 313.308 g·mol−1 |
| Heat of Formation | -426.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.85 ± 1.08 D |
| Volume | 365.46 Å 3 |
| Surface Area | 317.54 Å 2 |
| HOMO Energy | -9.21 ± 0.55 eV |
| LUMO Energy | -0.38 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IBXZTXVMQARJHH-CYBMUJFWSA-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 |