(2E)-3-(3-{4-Chloro-2-[2-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)Ethoxy]Phenoxy}Phenyl)Acrylonitrile
Properties
| Property | Value |
|---|---|
| Formula | C21H16ClN3O4 |
| IUPAC Name | (e)-3-[3-[4-chloro-2-[2-(2,4-dioxopyrimidin-1-yl)ethoxy]phenoxy]phenyl]prop-2-enenitrile |
| Molecular Mass | 409.822 g·mol−1 |
| Heat of Formation | -258.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.83 ± 1.08 D |
| Volume | 461.85 Å 3 |
| Surface Area | 396.53 Å 2 |
| HOMO Energy | -9.44 ± 0.55 eV |
| LUMO Energy | 1.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AXHHDHSEUVTPBV-DUXPYHPUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |