Related Products of 41979-39-9, Children learn through play, and they learn more than adults might expect. Science experiments are a great way to spark their curiosity, 41979-39-9, Name is Piperidin-4-one hydrochloride, SMILES is O=C1CCNCC1.[H]Cl, belongs to piperidines compound. In a article, author is Periyannan, P., introduce new discover of the category.
Crystal structure, Hirshfeld surface analysis and DFT studies of 1-[r-2,c-6-diphenyl-t-3-(propan-2-yl)piperidin-1-yl]ethan-1-one
In the title compound, C22H27NO, the piperidine ring adopts a chair conformation. The dihedral angles between the mean plane of the piperidine ring and the phenyl rings are 89.78 (7) and 48.30 (8)degrees. In the crystal, molecules are linked into chains along the b-axis direction by C-H center dot center dot center dot O hydrogen bonds. The DFT/B3LYP/6-311 G(d,p) method was used to determine the HOMO-LUMO energy levels. The molecular electrostatic potential surfaces were investigated by Hirshfeld surface analysis and two-dimensional fingerprint plots were used to analyse the intermolecular interactions in the molecule.
Related Products of 41979-39-9, Each elementary reaction can be described in terms of its molecularity, the number of molecules that collide in that step. The slowest step in a reaction mechanism is the rate-determining step.you can also check out more blogs about 41979-39-9.
Reference:
Piperidine – Wikipedia,
,Piperidine | C5H11N – PubChem