| Formula |
C21H16N4O4 |
| IUPAC Name |
4-(1,3-benzodioxol-5-yloxy)-2-[4-(4h-imidazol-3-ium-4-ylium-3-yl)phenoxy]-6-methyl-pyrimidine |
| Molecular Mass |
388.376 g·mol−1 |
| Heat of Formation |
-61.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.99 ± 1.08 D |
| Volume |
439.23 Å 3 |
| Surface Area |
342.58 Å 2 |
| HOMO Energy |
-8.97 ± 0.55 eV |
| LUMO Energy |
2.25 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-(1,3-benzodioxol-5-yloxy)-2-(4-imidazol-1-ylphenoxy)-6-methyl-pyrimidine
- 4-(1,3-benzodioxol-5-yloxy)-2-(4-imidazol-1-ylphenoxy)-6-methylpyrimidine
- 4-(1,3-benzodioxol-5-yloxy)-2-[4-(1-imidazolyl)phenoxy]-6-methylpyrimidine
|
| InChIKey |
QQBNDYARFVOEGW-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
|
| |
|
