3-(4-Methyl-1-Piperazinyl)-N-(3-Nitrobenzyl)-7-(Trifluoromethyl)-5-Quinolinamine
Properties
Property | Value |
---|---|
Formula | C22H22F3N5O2 |
IUPAC Name | 3-(4-methylpiperazin-1-yl)-n-[(3-nitrophenyl)methyl]-7-(trifluoromethyl)quinolin-5-amine |
Molecular Mass | 445.438 g·mol−1 |
Heat of Formation | -325.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.00 ± 1.08 D |
Volume | 494.33 Å 3 |
Surface Area | 441.53 Å 2 |
HOMO Energy | -8.49 ± 0.55 eV |
LUMO Energy | 1.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | JIYPGFPFAVEPFX-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C F O N |