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芴-9-酮肟

Fluoren-9-one oxime.

作者信息

Bugenhagen Bernhard, Al Jasem Yosef, Al-Azani Mariam, Thiemann Thies

机构信息

Institute for Inorganic and Applied Chemistry, University of Hamburg, Martin-Luther-King-Platz 6, D-20146 Hamburg, Germany.

Department of Chemical Engineering, United Arab Emirates University, AL Ain, Abu Dhabi, United Arab Emirates.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Feb 8;70(Pt 3):o265. doi: 10.1107/S1600536814002669. eCollection 2014 Mar 1.

Abstract

In the title mol-ecule, C13H9NO, the fluorene system and the oxime group non-H atoms are essentially coplanar, with a maximum deviation from the fluorene mean plane of 0.079 (2) Å for the oxime O atom. A short intra-molecular C-H⋯O generates an S(6) ring. In the crystal, mol-ecules related by a twofold screw axis are connected by O-H⋯N hydrogen bonds, forming [100] chains Within these chains, mol-ecules related by a unit translation along [100] show π-π stacking inter-actions between their fluorene ring systems with an inter-planar distance of 3.347 (2) Å. The dihedral angle between the fluorene units of adjacent mol-ecules along the helix is 88.40 (2)°. There is a short C-H⋯π contact between the fluorene groups belonging to neighbouring chains.

摘要

在标题分子C₁₃H₉NO中,芴体系和肟基的非氢原子基本共面,肟O原子与芴平均平面的最大偏差为0.079 (2) Å。一个短的分子内C—H⋯O形成一个S(6)环。在晶体中,由二重螺旋轴相关的分子通过O—H⋯N氢键相连,形成[100]链。在这些链内,沿[100]通过单位平移相关的分子在其芴环体系之间表现出π–π堆积相互作用,平面间距为3.347 (2) Å。沿螺旋方向相邻分子的芴单元之间的二面角为88.40 (2)°。相邻链的芴基团之间存在短的C—H⋯π接触。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a96/3998413/954a11b5dd87/e-70-0o265-fig1.jpg

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