Suppr超能文献

二水双(N,N-二乙基烟酰胺-κN)双[4-(二甲基氨基)苯甲酸根-κO]钴(II)

Diaqua-bis-(N,N-diethyl-nicotinamide-κN)bis[4-(dimethyl-amino)-benzoato-κO]cobalt(II).

作者信息

Hökelek Tuncer, Dal Hakan, Tercan Barış, Aybirdi Ozgür, Necefoğlu Hacali

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Aug 8;65(Pt 9):m1051-2. doi: 10.1107/S1600536809030980.

Abstract

The title Co(II) complex, [Co(C(9)H(10)NO(2))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], is centrosymmetric. It contains two dimethyl-amino-benzoate (DMAB) and two diethyl-nicotinamide (DENA) ligands and two water mol-ecules, all of them being monodentate. The four O atoms in the equatorial plane around the Co atom form a slightly distorted square-planar arrangement, while the slightly distorted octa-hedral coordination is completed by the two pyridine N atoms of DENA ligands with the Co-N distance of 2.1519 (11) Å in the axial positions. The Co atom is displaced out of the least-squares plane of the carboxyl-ate group by -0.781 (1) Å. The dihedral angle between the carboxyl-ate group and the adjacent benzene ring is 5.05 (7)°, while the pyridine and benzene rings are oriented at a dihedral angle of 71.48 (5)°. In the crystal structure, inter-molecular O-H⋯O and C-H⋯O hydrogen bonds link the mol-ecules into a three-dimensional network. Two weak C-H⋯π inter-actions are also present.

摘要

标题化合物Co(II)配合物[Co(C₉H₁₀NO₂)₂(C₁₀H₁₄N₂O)₂(H₂O)₂]是中心对称的。它包含两个二甲基氨基苯甲酸酯(DMAB)和两个二乙基烟酰胺(DENA)配体以及两个水分子,它们均为单齿配体。Co原子周围赤道平面上的四个O原子形成略微扭曲的平面正方形排列,而轴向位置上DENA配体的两个吡啶N原子则使配位略微扭曲为八面体,Co-N键长为2.1519(11) Å。Co原子偏离羧酸根基团的最小二乘平面0.781(1) Å。羧酸根基团与相邻苯环之间的二面角为5.05(7)°,而吡啶环和苯环之间的二面角为71.48(5)°。在晶体结构中,分子间的O-H⋯O和C-H⋯O氢键将分子连接成三维网络。同时还存在两个弱的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ef43/2970090/d6e70f6204e9/e-65-m1051-fig1.jpg

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验