Computed Properties of C14H11N. Recently I am researching about MOLECULAR-ORBITAL METHODS; GAUSSIAN-TYPE BASIS; PRIMARY AMINES; SELECTIVE HYDROGENATION; EQUILIBRIUM GEOMETRIES; INSERTION REACTIONS; HYDROFORMYLATION; HYDROGENOLYSIS; APPROXIMATION; ALDEHYDES, Saw an article supported by the Austrian Science Fund (FWF)Austrian Science Fund (FWF) [P29584-N28]; Fundacao para a Ciencia e TecnologiaPortuguese Foundation for Science and TechnologyEuropean Commission [UID/QUI/00100/2013]. Published in WILEY-V C H VERLAG GMBH in WEINHEIM ,Authors: Weber, S; Veiros, LF; Kirchner, K. The CAS is 86-29-3. Through research, I have a further understanding and discovery of 2,2-Diphenylacetonitrile
An efficient additive-free manganese-catalyzed hydrogenation of nitriles to primary amines with molecular hydrogen is described. The pre-catalyst, a well-defined bench-stable alkyl bisphosphine Mn(I) complex fac-[Mn(dpre)(CO)(3)(CH3)] (dpre=1,2-bis(di-n-propylphosphino)ethane), undergoes CO migratory insertion into the manganese-alkyl bond to form acyl complexes which upon hydrogenolysis yields the active coordinatively unsaturated Mn(I) hydride catalyst [Mn(dpre)(CO)(2)(H)]. A range of aromatic and aliphatic nitriles were efficiently and selectively converted into primary amines in good to excellent yields. The hydrogenation of nitriles proceeds at 100 degrees C with a catalyst loading of 2 mol % and a hydrogen pressure of 50 bar. Mechanistic insights are provided by means of DFT calculations.
Computed Properties of C14H11N. About 2,2-Diphenylacetonitrile, If you have any questions, you can contact Weber, S; Veiros, LF; Kirchner, K or concate me.
Reference:
Benzodioxan,
,1,4-Benzodioxane | C8H8O2 – PubChem