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2,3,5-三苯基吡嗪

2,3,5-Triphenyl-pyrazine.

作者信息

Anuradha N, Thiruvalluvar A, Pandiarajan K, Chitra S, Butcher R J

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2008 Dec 13;65(Pt 1):o106. doi: 10.1107/S1600536808041627.

Abstract

In the title mol-ecule, C(22)H(16)N(2), the pyrazine ring deviates very slightly from planarity [maximum deviation 0.044 (3) Å], tending towards a twist-boat conformation. The phenyl ring at position 3 makes dihedral angles of 64.0 (2) and 45.8 (2)°, respectively, with the phenyl rings at positions 2 and 5. The dihedral angle between the phenyl rings at positions 2 and 5 is 49.7 (2)°. A C-H⋯π inter-action is found in the crystal structure, but no classical hydrogen bonds form.

摘要

在标题分子C₂₂H₁₆N₂中,吡嗪环与平面的偏差非常小[最大偏差为0.044(3)Å],趋于扭船构象。3位的苯环与2位和5位的苯环分别形成64.0(2)°和45.8(2)°的二面角。2位和5位苯环之间的二面角为49.7(2)°。在晶体结构中发现了C—H⋯π相互作用,但未形成经典氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/658e/2968030/c9538bfda946/e-65-0o106-fig1.jpg

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