Synthesis and crystal structure of catena-poly[[[aqua-(2,3-di-methyl-pyrazine-κ N)cadmium(II)]-di-μ-bromido] 2,3-di-methyl-pyrazine monosolvate hemihydrate] [0.03%]
(catena-聚[[双溴化二μ-溴-(2，3-二甲基吡嗪-κN)镉(II))水合2，3-二甲基吡啶单溶剂化合物半 hydrate]的合成及晶体结构
Christian Näther
Christian Näther
Crystals of the title compound, {[CdBr2(C6H8N2)(H2O)]·C6H8N2·0.5H2O} n (C6H8N2 = 2,3-di-methyl-pyrazine), were obtained accidentally by the reaction of cadmium bromide with 2,3-di-methyl-pyrazine in water. The asymmetric unit consists of ...
The crystal structure of (3 Z)-4-[(3-hy-droxy-phen-yl)amino]-pent-3-en-2-one: helices and π-stacking inter-actions of hy-dro-gen-bridged rings [0.03%]
(3Z)-4-[[（3-羟基苯基）氨基]亚甲基]环己烯-1-酮的晶体结构：氢键连接的环之间形成的螺旋和π堆积相互作用
Jebreil Syed,Alen Hadzovic
Jebreil Syed
The title com-pound, C11H13NO2, crystallizes in the monoclinic space group P21/c with four mol-ecular units per unit cell and Z' = 1. A strong intra-molecular N-H⋯O inter-action results in a six-membered hy-dro-gen-bridged ring. An inter-m...
Synthesis, crystal structure and Hirshfeld analysis of the bis-{(E)-2-[1-(benzo[ d][1,3]dioxol-5-yl)ethylidene]- N-ethyl-hydrazine-1-carbo-thio-amide-κ S}di-chlorido-mercury(II) complex [0.03%]
二氯化双{(E)-2-[1-(苯并[d][1,3]二氧戊环-5-基)乙烯亚基]-N-乙基-N'-[2-(三氟甲基)苯基]甲酰二硫}合汞(II)的合成、晶体结构和Hirshfeld面分析
Renan Lira de Farias,Johannes Beck,Jörg Daniels et al.
Renan Lira de Farias et al.
The title compound, [HgCl2(C12H15N3O2S)2], was synthesized by the reaction of (E)-2-[1-(benzo[d][1,3]dioxol-5-yl)ethyl-idene]-N-ethyl-hydrazine-1-carbo-thio-amide [common name: 3',4'-(methyl-enedi-oxy)aceto-phenone 4-ethyl-thio-semicarbazon...
Crystal structure and Hirshfeld surface analysis of 1-(furan-2-yl)-2-(thio-phene-2-carbon-yl)-3-(thio-phen-2-yl)-2,3,3a,8a-tetra-hydro-cyclo-penta-[ a]inden-8(1 H)-one [0.03%]
1-(呋喃-2-基)-2-(噻吩-2-甲酰基)-3-(噻苯-2-基)-2,3,3a,8a-四氢环戊[a]茚-8(1H)-酮的晶体结构和Hirshfeld面分析
Hayreddin Gezegen,Gamze Ordu,Zeliha Atioğlu et al.
Hayreddin Gezegen et al.
In the title compound, C25H18O3S2, the terminal cyclo-pentane ring adopts an envelope conformation. In the racemic crystal, pairs of enanti-omers are linked by C-H⋯O hydrogen inter-actions, forming R 2 2(10) ring motifs. The (1R,2S,3S,3aR,...
Insights into [(2-phen-oxy-phen-yl)lithium(THF)(TMEDA)] and diphenyl ether: structural influence of metalation on the aromatic system [0.03%]
关于[(2-苯氧基苯基)锂(THF)(TMEDA)]和二苯醚：金属化对芳香体系结构影响的见解
Michael Nuss,Tobias Schrimpf,Carsten Strohmann
Michael Nuss
The title compound, (2-phen-oxy-phenyl-κC 1)(tetra-hydro-furan-κO)(N,N,N',N'-tetra-methyl-ethylenedi-amine-κ2 N,N')lithium, [Li(C12H9O)(C6H16N2)(C4H8O)] or [(2-phen-oxy-phen-yl)lithium(THF)(TMEDA)], (1), is a monomeric lithium complex in...
Synthesis, crystal structure determination, Hirshfeld surface and crystal void analyses, inter-action energy calculations and energy frameworks of (3a RS,4 RS,9a RS)-2-benzyl-3-oxo-2,3,3a,4,9,9a-hexa-hydro-1 H-benzo[ f]iso-indole-4-carb-oxy-lic acid [0.03%]
合成、晶体结构测定、Hirshfeld面及空穴分析、相互作用能量计算和(3a RS，4 RS，9a RS)-2-苯甲基-3-氧代-2,3,3a,4,9,9a-六氢-1 H-苯并[f]异吲哚-4-羧酸的能量框架分析
Kseniia A Alekseeva,Tuncer Hökelek,Victor N Khrustalev et al.
Kseniia A Alekseeva et al.
The title compound, C20H19NO3, consists of a benzyl moiety bonded to the nitro-gen atom of a 1H-benzo[f]iso-indole-4-carb-oxy-lic acid group. The fused pyrrole and cyclo-hexene rings of the iso-indole group are in envelope and flattened-boa...
Synthesis and crystal structure of a mixed-metal 3D coordination polymer poly[[bis-(μ5-anthra-quinone-1,8-di-sulfonato-κ5 O: O': O'': O''': O'''')di-μ2-aqua-κ4 O: O-tetra-aqua-copper(II)disodium] dihydrate] [0.03%]
混合金属3D配位聚合物双[双-(五硫酸化蒽醌-1,8-)二-水桥四水合铜(II)钠]脱水物的合成与晶体结构测定
Xuan-Yi Chen,Jia Wei,Juan He et al.
Xuan-Yi Chen et al.
Metal-organic hybrid materials have attracted a great deal of research inter-est due to their potential applications in the field such as gas storage and separation, heterogeneous catalysis, chemical/biological sensing and detection, energy...
A new hexa-gonal polymorph of magnesium perchlorate hexa-hydrate obtained from an acetamide medium [0.03%]
通过乙酰胺介质获得六水合高氯酸镁的新六方多晶型物
Gergana Velyanova,Krasimir Kossev,Rositsa Nikolova
Gergana Velyanova
A new magnesium perchlorate hexa-hydrate phase, Mg(ClO4)2·6H2O, was obtained from the mixed solvents of water and acetamide. The structure crystallizes in the hexa-gonal space group P63mc and is isostructural with previously reported M(ClO...
Crystal structures of two hydrous sodium potassium molybdates: Na3K(MoO4)2(H2O)9 and NaK(MoO4)(H2O) [0.03%]
两种含水的钠钾钼酸盐的晶体结构：Na₃KMoo₄₂(H₂O)₉和NaKMMoo₄(H₂O)
Volker Kahlenberg
Volker Kahlenberg
Single-crystals of the hydrated sodium potassium orthomolybdate phases Na3K(MoO4)2(H2O)9, tris-odium potassium bis-(orthomolybdate) nona-hydrate, and NaK(MoO4)(H2O), sodium potassium orthomolybdate monohydrate, were obtained as by-products ...
Crystal structure of binimetinib (Form A), C17H15BrF2N4O3, from synchrotron X-ray powder diffraction data and density functional theory [0.03%]
基于同步辐射X射线粉末衍射数据和密度泛函理论的Binimetinib（A型）晶体结构，分子式为C17H15BrF2N4O3
Jean Guillaume Ducreux,James A Kaduk,Anja Dosen et al.
Jean Guillaume Ducreux et al.
The crystal structure of binimetinib Form A [systematic name: 6-(4-bromo-2-fluoroanilino)-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide], C17H15BrF2N4O3, has been solved and refined using synchrotron X-ray powder diffract...