首页> 外文期刊>Journal of chemical crystallography >Crystal and Molecular Structures of Three Salts from Diethylenetriamine, 3,5-Dinitrobenzoic Acid, 2-Hydroxy-5-(Phenyldiazenyl)Benzoic Acid, and 5-Nitrosalicylic Acid
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Crystal and Molecular Structures of Three Salts from Diethylenetriamine, 3,5-Dinitrobenzoic Acid, 2-Hydroxy-5-(Phenyldiazenyl)Benzoic Acid, and 5-Nitrosalicylic Acid

机译:二亚乙基三胺,3,5-二硝基苯甲酸,2-羟基-5-(苯基二氮烯基)苯甲酸和5-硝基水杨酸的三种盐的晶体和分子结构

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The preparation, X-ray crystal structure, fourier transform infrared (FTIR) spectroscopy, and elemental analysis of three compounds based on diethylenetriamine and aromatic carboxylic acids are reported. XRD and FTIR analysis indicated that all these complexes are organic salt. The compound 1 crystallizes in the triclinic, space group P-1, with a = 8.5665(8) , b = 11.8387(9) , c = 12.4901(11) , alpha = 77.2580(10)A degrees, beta A = 77.1820(10)A degrees, gamma A = 78.290(2)A degrees, V = 1,188.81(18) (3), Z = 2. The compound 2 crystallizes in the triclinic, space group P-1, with a = 8.0040(7) , b = 9.4869(8) , c = 20.3491(18) , alpha = 84.6370(10)A degrees, beta A = 87.032(2)A degrees, gamma A = 78.9620(10)A degrees, V = 1,509.0(2) (3), Z = 2. The compound 3 crystallizes in the orthorhombic, space group Pbca, with a = 12.1232(11) , b = 13.5714(14) , c = 26.179(3) , alpha = 90A degrees, beta A = 90A degrees, gamma A = 90A degrees, V = 4,307.3(7) (3), Z = 8. The supramolecular architectures of 1-3 involve extensive hydrogen bonding including N-H center dot center dot center dot O, N-H center dot center dot center dot N, and O-H center dot center dot center dot O interactions as well as other non-covalent CH-O, CH2-O, O-pi, NH3 (+)-pi, CH2-pi, and pi center dot center dot center dot pi interactions, giving 3D framework structures.
机译:报告了三种基于二亚乙基三胺和芳族羧酸的化合物的制备,X射线晶体结构,傅立叶变换红外(FTIR)光谱和元素分析。 XRD和FTIR分析表明所有这些配合物都是有机盐。化合物1在三斜晶空间群P-1中结晶,a = 8.5665(8),b = 11.8387(9),c = 12.4901(11),alpha = 77.2580(10)A度,beta A = 77.1820( 10)A度,伽马A = 78.290(2)A度,V = 1,188.81(18)(3),Z = 2.化合物2在三斜晶系空间群P-1中结晶,a = 8.0040(7) ,b = 9.4869(8),c = 20.3491(18),alpha = 84.6370(10)A度,beta A = 87.032(2)A度,γA = 78.9620(10)A度,V = 1,509.0(2) (3),Z =2。化合物3在正交空间组Pbca中结晶,其a = 12.1232(11),b = 13.5714(14),c = 26.179(3),alpha = 90A度,beta A = 90A度,γA = 90A度,V = 4,307.3(7)(3),Z =8。1-3的超分子结构涉及广泛的氢键,包括NH中心点中心点中心点O,NH中心点中心点中心点N和OH中心点中心点中心点O相互作用以及其他非共价CH-O,CH2-O,O-pi,NH3(+)-pi,CH2-pi和pi中心点中心点中心点pi交互,提供3D框架结构。

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