4-(1,3-Benzodioxol-5-Yloxy)-2-[4-(1H-Imidazol-1-Yl)Phenoxy]Pyrimidine
Properties
Property | Value |
---|---|
Formula | C20H14N4O4 |
IUPAC Name | 4-(1,3-benzodioxol-5-yloxy)-2-[4-(4h-imidazol-3-ium-4-ylium-3-yl)phenoxy]pyrimidine |
Molecular Mass | 374.350 g·mol−1 |
Heat of Formation | -15.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.06 ± 1.08 D |
Volume | 419.08 Å 3 |
Surface Area | 323.18 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | 2.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | XPXGYINSBORUMM-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H C O N |