(1R,2R,3S,5S)-3-(4-Chlorophenyl)-8-Methyl-2-(5-Phenyl-1,3,4-Oxadiazol-2-Yl)-8-Azabicyclo[3.2.1]Octane
Properties
Property | Value |
---|---|
Formula | C22H22ClN3O |
IUPAC Name | 2-[3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]-5-phenyl-1,3,4-oxadiazole |
Molecular Mass | 379.883 g·mol−1 |
Heat of Formation | 189.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.40 ± 1.08 D |
Volume | 449.41 Å 3 |
Surface Area | 370.96 Å 2 |
HOMO Energy | -9.32 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | BTMJKIPIYJYOOV-FYQPLNBISA-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 Cl |