Chemistry is traditionally divided into organic and inorganic chemistry. The former is the study of compounds containing at least one carbon-hydrogen bonds. 91-02-1, Name is Phenyl(pyridin-2-yl)methanone, molecular formula is C12H9NO, belongs to pyridine-derivatives compound, is a common compound. In a patnet, author is Yang, Wenhong, once mentioned the new application about 91-02-1, Computed Properties of C12H9NO.
Effect of cycloalkyl-fused ring on the catalytic performance of bis(imino) pyridine metal complexes by QSPR modeling
The catalytic performance of cycloalkyl-fused bis(arylimino)pyridine metal precatalysts toward ethylene polymerization is investigated by quantitative structure-property relationship (QSPR) modeling to explain the effect of different sizes of cycloalkyl-fused ring. 2D-QSPR results provide information about the main contribution of the conjugation degree in the precatalysts for catalytic activity. Furthermore, 3D-QSPR results indicate the favorable structure of the asymmetric cycloalkyl-fused ring for catalytic activity. On the contrary, symmetric cycloalkyl-fused rings with bulky groups increase the molecular weight of the product. This study may provide theoretical guidance to design new precatalysts with desirable performance in further experiments.
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Reference:
Pyridine – Wikipedia,
,Pyridine | C5H5N – PubChem