3-[(4S)-5-Oxo-2-(Trifluoromethyl)-1,4,5,6,7,8-Hexahydro-4-Quinolinyl]Benzonitrile
Properties
Property | Value |
---|---|
Formula | C17H13F3N2O |
IUPAC Name | 3-[(4s)-5-oxo-2-(trifluoromethyl)-4,6,7,8-tetrahydro-1h-quinolin-4-yl]benzonitrile |
Molecular Mass | 318.293 g·mol−1 |
Heat of Formation | -525.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.36 ± 1.08 D |
Volume | 346.17 Å 3 |
Surface Area | 307.67 Å 2 |
HOMO Energy | -9.02 ± 0.55 eV |
LUMO Energy | 2.17 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | RUVMMEREJMHLOS-LBPRGKRZSA-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 |