Nikolaev Institute of Inorganic Chemistry SB RAS, 3 Lavrentiev Pr., 630090 Novosibirsk, Russia.
Int J Mol Sci. 2023 Jan 19;24(3):2034. doi: 10.3390/ijms24032034.
In this work, octafluoro-substituted phthalocyanines of zinc, vanadyl, and cobalt (MPcF, M = Zn(II), Co(II), VO) were synthesized and studied. The structures of single crystals of the obtained phthalocyanines were determined. To visualize and compare intermolecular contacts in MPcF, an analysis of Hirshfeld surfaces (HS) was performed. MPcF nanoscale thickness films were deposited by organic molecular beam deposition technique and their structure and orientation were studied using X-ray diffraction. Comparison of X-ray diffraction patterns of thin films with the calculated diffractograms showed that all three films consisted of a single crystal phase, which corresponded to a phase of single crystals. Only one strong diffraction peak corresponding to the plane (001) was observed on the diffraction pattern of each film, which indicated a strong preferred orientation with the vast majority of crystallites oriented with a (001) crystallographic plane parallel to the substrate surface. The effect of the central metals on the electronic absorption and vibrational spectra of the studied phthalocyanines as well as on the electrical conductivity of their films is also discussed.
在这项工作中,合成并研究了八氟取代酞菁锌、氧钒和钴(MPcF,M=Zn(II)、Co(II)、VO)。获得的酞菁的单晶结构已确定。为了可视化和比较 MPcF 中的分子间接触,进行了 Hirshfeld 表面(HS)分析。通过有机分子束沉积技术沉积了 MPcF 的纳米级厚度薄膜,并使用 X 射线衍射研究了它们的结构和取向。将薄膜的 X 射线衍射图谱与计算的衍射图谱进行比较表明,所有三种薄膜均由单晶相组成,这与单晶的相一致。每个薄膜的衍射图谱上仅观察到一个对应于平面(001)的强衍射峰,这表明具有强烈的择优取向,绝大多数晶体的(001)晶面平行于基底表面取向。还讨论了中心金属对所研究酞菁的电子吸收和振动光谱以及其薄膜电导率的影响。