3-[(3-Butyl-5-Isopropyl-2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinyl)Carbonyl]-5-Methylbenzonitrile
Properties
| Property | Value |
|---|---|
| Formula | C20H23N3O3 |
| IUPAC Name | 3-(3-butyl-5-isopropyl-2,6-dioxo-pyrimidine-4-carbonyl)-5-methyl-benzonitrile |
| Molecular Mass | 353.415 g·mol−1 |
| Heat of Formation | -396.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.88 ± 1.08 D |
| Volume | 439.5 Å 3 |
| Surface Area | 371.57 Å 2 |
| HOMO Energy | -9.54 ± 0.55 eV |
| LUMO Energy | 1.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PPJRWFFVCKGABJ-UHFFFAOYSA-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 |