Formula |
C19H18FN5O |
IUPAC Name |
5-[1-(2-fluoropyridin-3-yl)-5-methyltriazol-4-yl]-2-propyl-3h-isoindol-1-one |
Molecular Mass |
351.378 g·mol−1 |
Heat of Formation |
130.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.12 ± 1.08 D |
Volume |
409.86 Å 3 |
Surface Area |
359.51 Å 2 |
HOMO Energy |
-9.25 ± 0.55 eV |
LUMO Energy |
1.58 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 5-[1-(2-fluoro-3-pyridyl)-5-methyl-4-triazolyl]-2-propyl-1-isoindolinone
- 5-[1-(2-fluoro-3-pyridyl)-5-methyl-triazol-4-yl]-2-propyl-isoindolin-1-one
- 5-[1-(2-fluoropyridin-3-yl)-5-methyl-1,2,3-triazol-4-yl]-2-propyl-3h-isoindol-1-one
|
InChIKey |
NYDVTBHNZHBCKX-UHFFFAOYSA-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
F
|
|
|