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Studies on activation of C-H bond and insertion reaction of CO, CO2 into M-C bond using (Ir(COD)(diphos))Cl complexes

✍ Scribed by Li Guang-Nian; Jin Hong; Zhang Liang-Fu


Book ID
112058673
Publisher
John Wiley and Sons
Year
1987
Tongue
English
Weight
369 KB
Volume
5
Category
Article
ISSN
0256-7660

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Quantum mechanical calculations at the MP4 (SDQ) level using the BP86-optimized geometries were carried out to investigate the energies and reaction mechanism for the propene (CH 3 -C 1 H=CH 2 2 ) insertion reaction into the Rh-H bond, using the cis-HRh(CO)(PH 3 ) 2 compound as a model catalytic sp