1,1′-Diethyl-4,4′-bipyridine-1,1′-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): multiple C—H...N hydrogen bonds form a complex sheet structure

Zouaoui; Lehchili; Fouzia; Setifi; Fatima; Beghidja; Adel; Ng; Seik Weng; Glidewell; Christopher

首页> 外文期刊>Acta crystallographica. Section C, Structural chemistry. >1,1′-Diethyl-4,4′-bipyridine-1,1′-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): multiple C—H...N hydrogen bonds form a complex sheet structure

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1,1′-Diethyl-4,4′-bipyridine-1,1′-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): multiple C—H...N hydrogen bonds form a complex sheet structure

机译：1,1'-二乙基-4,4'-联吡啶-1,1'-二双（1,1,3,3-四氰基-2-乙氧基丙烯）：多个C ... N个氢键形成配合物片状结构

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摘要

In the title salt, C14H18N22+·2C9H5N4O?, the 1,1′-diethyl-4,4′-bipyridine-1,1′-diium dication lies across a centre of inversion in the space group P21/c. In the 1,1,3,3-tetracyano-2-ethoxypropenide anion, the two independent –C(CN)2 units are rotated, in conrotatory fashion, out of the plane of the central propenide unit, making dihedral angles with the central unit of 16.0?(2) and 23.0?(2)°. The ionic components are linked by C—H...N hydrogen bonds to form a complex sheet structure, within which each cation acts as a sixfold donor of hydrogen bonds and each anion acts as a threefold acceptor of hydrogen bonds.

机译：在标题盐C 14 H 18 N 22 +·2C 9 H 5 N 4 O 3中，1，1′-二乙基-4，4′-联吡啶-1，1′-二鎓指示物位于空间群P21 / c的反转中心。在1,1,3,3-四氰基-2-乙氧基丙二烯阴离子中，两个独立的–C（CN）2单元以旋转方式从中心丙二酸酯单元的平面旋转出，与中心二面角单位为16.0？（2）和23.0？（2）°。离子成分通过CHN ... N氢键连接形成复杂的片状结构，其中每个阳离子充当氢键的六倍供体，每个阴离子充当氢键的三倍受体。

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《Acta crystallographica. Section C, Structural chemistry.》 |2014年第3期|共4页
作者
Zouaoui; Lehchili; Fouzia; Setifi; Fatima; Beghidja; Adel; Ng; Seik Weng; Glidewell; Christopher;
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正文语种 eng
中图分类晶体学;
关键词
crystal structure; hydrogen-bonded sheets; polynitrile anions; 4; 4′-bipyridine-1; 1′-diium; 1; 1; 3; 3-tetracyano-2-ethoxypropenide;

机译：晶体结构;氢键合片;多腈阴离子;4;4'-联吡啶-1;1'-二铵;1;1;3;3-四氰基-2-乙氧基丙烯;

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1. 1,1′-Diethyl-4,4′-bipyridine-1,1′-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): multiple C—H...N hydrogen bonds form a complex sheet structure [J] . Zouaoui, Lehchili, Fouzia, Acta crystallographica. Section C, Structural chemistry. . 2014,第3期

机译：1,1'-二乙基-4,4'-联吡啶-1,1'-二双（1,1,3,3-四氰基-2-乙氧基丙烯）：多个C ... N个氢键形成配合物片状结构
2. Multiple N-H NC, C-H NC and nitrile interactions in 4,400-bipyridine-1,100-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): structure determination and DFT calculations of anion- ? p cation interaction energies [J] . Fatima Setifi Acta crystallographica. Section C, Structural chemistry. . 2015,第8期

机译：在4,400-硼吡啶-1,100-杜尼米（1,1,3,3-四环酮-2-乙氧基丙烯酯）中的多个N-H Nc，C-H Nc和腈相互作用：结构测定和阴离子的DFT计算 - ？ P阳离子交互能量
3. Interplay between Halogen/Hydrogen Bonding and Electrostatic Interactions in 1,1 '-Bis(4-iodobenzyl)-4,4 '-bipyridine-1,1 '-diium Salts [J] . Garcia MD, Blanco V, Platas-Iglesias C, Crystal growth & design . 2009,第12期

机译：1,1'-双（4-碘苄基）-4,4'-联吡啶-1,1'-二盐中卤素/氢键与静电相互作用的相互作用
4. Blue organic light emitting diode (OLED) from two-layer structure of 4,4'-bis(2,2'diphenylvinil)-1,1'-biphenyl (DPVBi) and PVK [C] . Othman, M.K., Salleh, . 2004

机译：由4,4'-双（2,2'diphenylvinil）-1,1'-联苯（DPVBi）和PVK的两层结构构成的蓝色有机发光二极管（OLED）
5. I. Tertiary aryl sulfonamides as new cross coupling partners for nickel catalyzed Kumada-Corriu-Tamao reductive and carbon-carbon bond forming cross coupling reactions. II. N-sulfonyl deprotection under mild nickel(0) catalyzed Kumada-Corriu-Tamao coupling conditions and development of the N-Ans protecting group. III. Synthesis and application of 3,3'-di-(2-pyridyl)-1,1'-bi-2-naphthol ligands [D] . Milburn, Robert Ronald 2004

机译：I.叔芳基磺酰胺作为镍催化的Kumada-Corriu-Tamao还原和碳-碳键形成交叉偶联反应的新交叉偶联伴侣。二。在温和的镍（0）下N-磺酰基脱保护催化了Kumada-Corriu-Tamao偶联条件和N-Ans保护基的发展。三， 3,3'-二-（2-吡啶基）-1,1'-bi-2-萘酚配体的合成及应用
6. Structure of a bis-amidinium derivative of Hoechst 33258 complexed to dodecanucleotide d(CGCGAATTCGCG) 2 : the role of hydrogen bonding in minor groove drug-DNA recognition [O] . GR Clark, DW Boykin, A Czarny, 1997

机译：Hoechst 33258的双ami衍生物与十二核苷酸d（CGCGAATTCGCG）2复合的结构：氢键在小沟药物-DNA识别中的作用
7. 1,1'-Diethyl-4,4'-bipyridine-1,1'-diium bis(1,1,3,3-tetracyano-2- ethoxypropenide) : multiple C-H⋯N hydrogen bonds form a complex sheet structure [O] . Setifi, Z., Lehchili, F., Setifi, F., 2014

机译：1,1'-二乙基-4,4'-联吡啶-1,1'-双二（1,1,3,3-四氰基-2-乙氧基丙烯）：多个C-H⋯N氢键形成复杂的片状结构
8. Theoretical Prediction of the Heats of Formation, Densities and Relative Sensitivities, and/or Synthetic Approaches Toward the Synthesis of High Energy Dense Materials (HEDMs): 3,5-Dinitro-1,3,5-Oxadiazinane, Bis-Adjacent RDX, Bis-Adjacent HMX, 4,4',6,6'-Tetranitro-1,1'-Bis(N-oxide)-5,5',6,6'-4H,4'H-5,5'-Bisimidazo Oxadiazole, and the Open-Cage Derivative of CL-20. [R] . Byrd, E. F., Sabatini, J. J. 2015

机译：形成热，密度和相对灵敏度的理论预测，和/或合成高能量密集材料（HEDms）的合成方法：3,5-二硝基-1,3,5-恶二唑烷，双相邻RDX，Bis - 相邻的HmX，4,4'，6,6'-四硝基-1,1'-双（N-氧化物）-5,5'，6,6'-4H，4'H-5,5'-双咪唑恶二唑和CL-20的开笼衍生物。

1,1′-Diethyl-4,4′-bipyridine-1,1′-diium bis(1,1,3,3-tetracyano-2-ethoxypropenide): multiple C—H...N hydrogen bonds form a complex sheet structure

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