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Synthesis and Crystal Structure of a Novel Chiral 1-Methylpropargyl Ester Carrying Azobenzene Moiety 被引量:8

Synthesis and Crystal Structure of a Novel Chiral 1-Methylpropargyl Ester Carrying Azobenzene Moiety
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摘要 A novel chiral methylpropargyl ester containing azobenzene moiety(S)-(-)-3-methyl-3-{4-[4-(n-octyloxy)phenylazophenyl]carbonyl}oxy-1-propyne 3(C25H30N2O3,Mr = 406.51) was synthesized and characterized by IR,NMR and single-crystal X-ray diffraction.The crystal is of monoclinic system,space group P21 with a=6.7610(17),b=7.675(2),c=22.749(7),β=97.613(6)°,V=1170.1(6)3,Z=2,Dc=1.154,F(000)=436,μ=0.076 mm-1,R=0.0544 and wR=0.1569 for 2444 observed reflections with Ⅰ〉2σ(Ⅰ).Structure analysis proved that the azobenzene presents a trans form, and intermolecular hydrogen bonds yield a 3D framework. The ehiral acetylene carrying azobenzene moieties can be a potential alternative nonlinear optical, helical polymer, and liquid crystalline material. A novel chiral methylpropargyl ester containing azobenzene moiety(S)-(-)-3-methyl-3-{4-[4-(n-octyloxy)phenylazophenyl]carbonyl}oxy-1-propyne 3(C25H30N2O3,Mr = 406.51) was synthesized and characterized by IR,NMR and single-crystal X-ray diffraction.The crystal is of monoclinic system,space group P21 with a=6.7610(17),b=7.675(2),c=22.749(7),β=97.613(6)°,V=1170.1(6)3,Z=2,Dc=1.154,F(000)=436,μ=0.076 mm-1,R=0.0544 and wR=0.1569 for 2444 observed reflections with Ⅰ〉2σ(Ⅰ).Structure analysis proved that the azobenzene presents a trans form, and intermolecular hydrogen bonds yield a 3D framework. The ehiral acetylene carrying azobenzene moieties can be a potential alternative nonlinear optical, helical polymer, and liquid crystalline material.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2010年第1期146-150,共5页 结构化学(英文)
基金 supported by the Scientific Research Foundation for the Returned Overseas Chinese Scholars, State Education Ministry
关键词 chiral acetylene AZOBENZENE crystal structure chiral acetylene, azobenzene, crystal structure
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