Seidel Pierre, Gottwald Franziska, Meier Eric, Mazik Monika
Institut für Organische Chemie Technische Universität Bergakademie, Freiberg, Leipziger Str 29 09599 Freiberg/Sachsen Germany.
Acta Crystallogr E Crystallogr Commun. 2024 Oct 24;80(Pt 11):1198-1201. doi: 10.1107/S2056989024009976. eCollection 2024 Oct 1.
Crystal growth of 2-(3,4,5-triphen-ylphen-yl)acetic acid () from aceto-nitrile yields a monosolvate, CHO·CHCN, of the space group 1. In the crystal, the title mol-ecule adopts a conformation in which the three phenyl rings are arranged in a paddlewheel-like fashion around the central arene ring and the carboxyl residue is oriented nearly perpendicular to the plane of this benzene ring. Inversion-symmetric dimers of O-H⋯O-bonded mol-ecules of represent the basic supra-molecular entities of the crystal structure. These dimeric mol-ecular units are further linked by C-H⋯O=C bonds to form one-dimensional supra-molecular aggregates running along the crystallographic [111] direction. Weak C-H⋯N inter-actions occur between the mol-ecules of and aceto-nitrile.
2-(3,4,5-三苯基苯基)乙酸( )从乙腈中结晶得到一种空间群为1的单溶剂合物CHO·CHCN。在晶体中,标题分子采取一种构象,其中三个苯环以桨轮状围绕中心芳烃环排列,羧基残基几乎垂直于该苯环的平面取向。由O-H⋯O键合的分子形成的对称二聚体代表了晶体结构的基本超分子实体。这些二聚分子单元通过C-H⋯O=C键进一步连接,形成沿晶体学[111]方向延伸的一维超分子聚集体。在 分子和乙腈之间存在弱的C-H⋯N相互作用。