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Ordered structures in polycarbonate studied by infrared and Raman spectroscopy, wide-angle X-ray scattering, and differential scanning calorimetry

机译:通过红外和拉曼光谱,广角X射线散射和差示扫描量热法研究了聚碳酸酯中的有序结构

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Ordered structures in samples of Bisphenol A polycarbonate (BPAPC) prepared by varying thermal and solvent conditions were investigated by infrared and Raman spectroscopy, wide-angle X-ray scattering (WAXS), and differential scanning calorimetry(DSC). Based on the spectroscopic analysis and ab initio quantum mechanical calculations of diphenyl carbonate as a model compound, an assignment of the bands conformationally sensitive to the trans-trans and cis-trans structures is proposed. Temperature dependences of the vibrational spectra of BPAPC show that cis-trans structure is the energetically preferred conformation in the amorphous state and in solution and its population can be increased with decreasing temperature in amorphous BPAPC even below the glass transition temperature. Differences in the degrees of ordering in semicrystalline BPAPC assessed from the vibrational spectra, WAXS, and DSC indicate partial order in the interfacial region between the crystalline and amorphous phases. In some solvents (toluene, benzene), aggregation of BPAPC occurs, leading to the ordered structure analogous to crystalline BPAPC. The order is preserved in semicrystalline BPAPC obtained by the room-temperature evaporation of the solvent. [References: 43]
机译:通过红外和拉曼光谱,广角X射线散射(WAXS)和差示扫描量热法(DSC)研究了通过改变热和溶剂条件制备的双酚A聚碳酸酯(BPAPC)样品中的有序结构。基于碳酸二苯酯作为模型化合物的光谱分析和从头算量子力学计算,提出了对反式和反式结构敏感的能带构象分配。 BPAPC振动光谱的温度依赖性表明,顺式-反式结构是非晶态和溶液中在能量上优选的构象,甚至在低于玻璃化转变温度时,随着非晶态BPAPC的温度降低,其结构也可以增加。根据振动光谱,WAXS和DSC评估,半结晶BPAPC中有序度的差异表明结晶相和非晶相之间的界面区域存在部分有序。在某些溶剂(甲苯,苯)中,BPAPC发生聚集,从而导致类似于晶体BPAPC的有序结构。该顺序保存在通过室温蒸发溶剂得到的半结晶BPAPC中。 [参考:43]

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