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α,α'-二氧代烯酮环二硫代缩酮类化合物的晶体结构研究

Study on the crystal strcutures of α,α'-dioxoketene cyclis dithioacetals
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摘要 The crystals of α,α’-dioxoketene cyclic dithioacetals were prepared and their crystal structures were determined by X-ray crystallography.The influence of bond lengths,bond angles,dihedral angles and the molecular conformation on different substituted cyclic dithionacetals aldehyde ketone was discussed.Compound A is Monoclinic form,P21/c Space group,Unit cell dimensions,a=0.78337(6)nm,b=O54937(4)nm,c=2.8243(2)nm,α=90°,β=90.7740(10)°,γ=90°,V=1.215(4)nm3,Z=4,Dc=1.445g/cm3,F(000)=552.Compound B is Orthorhombic form,P212121 Space group,Unit cell dimensions,a=0.5665(5)nm,b=0.7980(7)nm,c=2.924(3)nm,α=90°,β=90°,γ=90°,V=1.322(2)nm3,Z=4,Dc=1.399g/cm3,F(000)=584. The crystals of α,α'-dioxoketene cyclic dithioacetals were prepared and their crystal structures were determined by X-ray crystallography. The influence of bond lengths, bond angles, dihedral angles and the molecular conformation on different substituted cyclic dithionacetals aldehyde ketone was discussed. Compound A is Monoclinic form, P21/c Space group, Unit cell dimensions, a = 0.78337(6)nm, b = O54937(4)nm, c = 2.8243(2)nm, α = 90°, β = 90.7740(10)°, γ = 90°, V = 1.215(4)nm^3, Z = 4, Dc = 1.445g/cm^3, F(000) = 552. Compound B is Orthorhombic form, P212121 Space group, Unit cell dimensions, a = 0.5665(5)nm, b = 0.7980(7)nm, c = 2.924(3)nm, α = 90°, β = 90°, γ = 90°, V = 1.322(2)nm^3, Z = 4, Dc = 1.399g/cm^3, F(000) = 584.
出处 《化学研究与应用》 CAS CSCD 北大核心 2006年第11期1330-1333,共4页 Chemical Research and Application
关键词 α α'-二氧代烯酮环二硫代缩酮 晶体结构 构象 α,α'-dioxoketene cyclic dithioacetals crystal structure molecular conformation
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