3-(Cyclopropylmethyl)-7-(4-Phenyl-1-Piperidinyl)-8-(Trifluoromethyl)[1,2,4]Triazolo[4,3-A]Pyridine
Properties
Property | Value |
---|---|
Formula | C22H23F3N4 |
IUPAC Name | 3-(cyclopropylmethyl)-7-(4-phenyl-1-piperidyl)-8-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine |
Molecular Mass | 400.440 g·mol−1 |
Heat of Formation | -201.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.01 ± 1.08 D |
Volume | 460.93 Å 3 |
Surface Area | 389.97 Å 2 |
HOMO Energy | -9.28 ± 0.55 eV |
LUMO Energy | -1.37 ± eV |
Point Group Symmetry | C1 |
InChIKey | BQAVZGJJQFJSMW-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 F |