4-Ethynyl-N-[(2S,3R)-3-Hydroxy-1-Nitroso-1-Oxo-2-Butanyl]Benzamide
Properties
| Property | Value |
|---|---|
| Formula | C13H12N2O4 |
| IUPAC Name | 4-ethynyl-n-[(1s,2r)-2-hydroxy-1-(oxocarbamoyl)propyl]benzamide |
| Molecular Mass | 260.245 g·mol−1 |
| Heat of Formation | -114.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.09 ± 1.08 D |
| Volume | 305.12 Å 3 |
| Surface Area | 281.47 Å 2 |
| HOMO Energy | -9.77 ± 0.55 eV |
| LUMO Energy | 2.53 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JJXZDQZGPLQGCP-KCJUWKMLSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |