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Crystal Structure of Calix[4](dioxo) crown-6 Acetonitrile(1:3) Inclusion Complex
作者姓名:ZHONG Zhen-Lin  CHEN Yuan-Yin  LU Xue-Ran
作者单位:ZHONG Zhen-Lin; CHEN Yuan-Yin; LU Xue-Ran(Department of Chemistry,Wuhan University,Wuhan 430072)LUO Bao-Sheng;CHEN Liao-Rong(Center of Analytical Science,Wuhan University,Wuhan 430072)
摘    要:CrystalStructureofCalix[4](dioxo)crown-6Acetonitrile(1:3)InclusionComplexZHONGZhen-Lin;CHENYuan-Yin;LUXue-Ran(DepartmentofChe...


Crystal Structure of Calix[4](dioxo) crown-6 Acetonitrile(1:3) Inclusion Complex
ZHONG Zhen-Lin, CHEN Yuan-Yin, LU Xue-Ran.Crystal Structure of Calix[4](dioxo) crown-6 Acetonitrile(1:3) Inclusion Complex[J].Chinese Journal of Structural Chemistry,1996(5).
Authors:ZHONG Zhen-Lin  CHEN Yuan-Yin  LU Xue-Ran
Abstract:The X-ray crystal structure of the inclusion complex of p-tert-butylcalix 4] crown-6 with actonitrile is reported. C54H70O10·3CH3CN, Mr=1002. 3 ,monoclinic, space group C2/c with cell dimensions of a=23.587(7),b=21.153(6),c=15.608(8) A,β=116.99(3)°,V=6939.2 A3,Z=4, F(000)=2160,Dc=0.959 g/cm3,μ=1.114 cm-1; R=0.088 for 2066 reflections with I>3σ(I).The calixarene subunit exists in a distorted cone conformation. One of the three acetonitrile molecules is located in the intracavity of the calixarene subunit and the other two in the intermolecular channels.
Keywords:crystal structure  calixarene  calixcrown  acetonitrile inclusion complex
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