4-{3-[(4-Methyl-1-Benzothiophen-3-Yl)Methyl]-2-Oxo-2,3-Dihydro-1H-Benzimidazol-1-Yl}Butanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H20N2O3S |
| IUPAC Name | 4-[3-[(4-methylbenzothiophen-3-yl)methyl]-2-oxo-benzimidazole-1,3-diium-1-yl]butanoic acid |
| Molecular Mass | 380.460 g·mol−1 |
| Heat of Formation | -319.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.57 ± 1.08 D |
| Volume | 444.76 Å 3 |
| Surface Area | 379.44 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | 2.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WYBNXPWKJQJMLG-UHFFFAOYSA-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 |