6-[4-(4-Fluorophenyl)-1,3-Oxazol-5-Yl]-3-Isopropyl-2H-[1,2,4]Triazolo[4,3-A]Pyridin-4-Ium
Properties
Property | Value |
---|---|
Formula | C18H16FN4O+ |
IUPAC Name | 4-(4-fluorophenyl)-5-(3-isopropyl-7h-[1,2,4]triazolo[4,3-a]pyridin-4-ium-7-id-6-yl)oxazol-3-ium-5-ide |
Molecular Mass | 323.344 g·mol−1 |
Heat of Formation | 149.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.22 ± 1.08 D |
Volume | 371.71 Å 3 |
Surface Area | 331.47 Å 2 |
HOMO Energy | -9.16 ± 0.55 eV |
LUMO Energy | 2.54 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | OVCXRBARSPBVMC-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |