Vosegaard Emilie Skytte, Mamakhel Mohammad Aref Hasen, Parmar Vijay Singh, Bertelsen Andreas Dueholm, Iversen Bo Brummerstedt
Department of Chemistry, Aarhus University, Langelandsgade 140, 8000 Aarhus, Denmark.
Acta Crystallogr B Struct Sci Cryst Eng Mater. 2024 Oct 1;80(Pt 5):488-494. doi: 10.1107/S2052520624007509. Epub 2024 Sep 3.
Organic-inorganic hybrid crystals have diverse functionalities, for example in energy storage and luminescence, due to their versatile structures. The synthesis and structural characterization of a new cobalt-vanadium-containing compound, 2Co(en)·4HO (1) is presented. The crystal structure of 1, consisting of [Co(en)] complexes and chains of corner-sharing (VO) tetrahedra, was solved by single-crystal X-ray diffraction in the centrosymmetric space group P1. Phase purity of the bulk material was confirmed by infrared spectroscopy, scanning electron microscopy, elemental analysis and powder X-ray diffraction. The volume expansion of 1 was found to be close to 1% in the reported temperature range from 100 to 300 K, with a volume thermal expansion coefficient of 56 (2) × 10 K. The electronic band gap of 1 is 2.30 (1) eV, and magnetic susceptibility measurements showed that the compound exhibits a weak paramagnetic response down to 1.8 K, probably due to minor Co impurities (<1%) on the Co site.
有机-无机杂化晶体由于其多样的结构而具有多种功能,例如在能量存储和发光方面。本文报道了一种新型含钴钒化合物2Co(en)·4HO (1)的合成及结构表征。通过单晶X射线衍射在中心对称空间群P1中解析了1的晶体结构,其由[Co(en)]配合物和共用角顶的(VO)四面体链组成。通过红外光谱、扫描电子显微镜、元素分析和粉末X射线衍射确认了块状材料的相纯度。在报道的100至300 K温度范围内,发现1的体积膨胀接近1%,体积热膨胀系数为56 (2) × 10 K。1的电子带隙为2.30 (1) eV,磁化率测量表明该化合物在低至1.8 K时表现出微弱的顺磁响应,这可能是由于Co位点上存在少量Co杂质(<1%)。