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Synthesis and Structure of a Cp^*Ir Half-sandwich Complex Containing Azido and Bis(diphenylthiophosphoryl)amide Ligands

Synthesis and Structure of a Cp^*Ir Half-sandwich Complex Containing Azido and Bis(diphenylthiophosphoryl)amide Ligands
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摘要 The title complex [CpIr{N(Ph2PS)2}(N3)](N(Ph2PS)2=bis(diphenylthiophosphoryl)amide,Cp=pentamethylcyclopentadienyl) has been prepared and characterized by X-ray diffraction analysis.It crystallizes in monoclinic,space group P21/n with a=11.6946(1),b=18.9273(2),c=15.7859(1),β=105.731(1)°,V=3363.29(5)3,Z=4,Mr=817.92,Dc=1.615g/cm3,μ(MoKα)=4.219 mm-1,F(000)=1624,S=1.028,the final R=0.0355 and wR=0.0848 for 5987 observed reflections with Ⅰ〉2σ(Ⅰ) and 363 variables.The molecular structure of 1 consists of discrete monomeric molecule with a distorted octahedral configuration around the iridium atom, having a Cp^* ring at one face and bonded with a chelating bis(diphenylthiophosphoryl)amide group as well as a terminal azido ligand. The average Ir-S and Ir-N bond lengths are 2.416(1) and 2.121 (5) A, respectively. The title complex [CpIr{N(Ph2PS)2}(N3)](N(Ph2PS)2=bis(diphenylthiophosphoryl)amide,Cp=pentamethylcyclopentadienyl) has been prepared and characterized by X-ray diffraction analysis.It crystallizes in monoclinic,space group P21/n with a=11.6946(1),b=18.9273(2),c=15.7859(1),β=105.731(1)°,V=3363.29(5)3,Z=4,Mr=817.92,Dc=1.615g/cm3,μ(MoKα)=4.219 mm-1,F(000)=1624,S=1.028,the final R=0.0355 and wR=0.0848 for 5987 observed reflections with Ⅰ〉2σ(Ⅰ) and 363 variables.The molecular structure of 1 consists of discrete monomeric molecule with a distorted octahedral configuration around the iridium atom, having a Cp^* ring at one face and bonded with a chelating bis(diphenylthiophosphoryl)amide group as well as a terminal azido ligand. The average Ir-S and Ir-N bond lengths are 2.416(1) and 2.121 (5) A, respectively.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2010年第1期39-42,共4页 结构化学(英文)
基金 supported by the National Natural Science Foundation of China the Program for New Century Excellent Talents in University (20771003 and NCET-06-0556)
关键词 IRIDIUM PENTAMETHYLCYCLOPENTADIENYL AZIDE SYNTHESIS crystal structure iridium, pentamethylcyclopentadienyl, azide, synthesis, crystal structure,
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