Methyl 4,7-Dihydro-3-Isobutyl-6-Methyl-4-(Nitrophenyl)Thieno(2,3-B)-Pyridine-5-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C20H22N2O4S |
| IUPAC Name | methyl (4s)-3-isobutyl-6-methyl-4-(2-nitrophenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate |
| Molecular Mass | 386.465 g·mol−1 |
| Heat of Formation | -249.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.32 ± 1.08 D |
| Volume | 440.45 Å 3 |
| Surface Area | 348.03 Å 2 |
| HOMO Energy | -8.50 ± 0.55 eV |
| LUMO Energy | -1.17 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XMDAONMXKQHMCB-SFHVURJKSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |