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    Acta crystallographica. Section E, Crystallographic communications

    Acta crystallographica. Section E, Crystallographic communications

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    年发文量

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    论文(4603)

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    1Synthesis and Structure of Benzyl 4-{[4-(Hex-yloxy)benzo-yl]-oxy}benzoate.
    P Roopadevi, H T Srinivasa, H C Devarajegowda, R Karthik, B S Palakshamurthy

    In the title compound, C27H28O5, the aromatic ring of the 4-hexyl-oxybenzoyl moiety and the central benzoate ring are twisted relative to one another, subtending a dihedral angle of 39.7 (2)°. The pendant benzyl aromatic ring is nearly orthogonal to the central benzoate ring, forming a dihedral angle of 89.3 (2)°. The hex-yloxy chain adopts an extended, approximately all-anti conformation and two short intra-molecular C-H⋯O contacts are observed. In the extended structure, C-H⋯π inter-actions help to consolidate the packing. Hirshfeld surface analysis and the corresponding two-dimensional fingerprint plots indicate that H⋯H contacts constitute the largest contribution to the crystal surface, accounting for 55.4%, followed by C⋯H/H⋯C contacts (22.9%) and O⋯H/H⋯O contacts (16.3%).

    2026
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    2Synthesis and Crystal Structure of 4,6-Di-amino-3-(prop-2-en-1-yl)-2-sulfanyl-idene-2,3-di-hydro-1,3,5-triazin-1-ium Chloride.
    Reham A Mohamed-Ezzat,Benson M Kariuki,Galal H Elgemeie

    The title structure, C6H10N5S+·Cl-, comprises two independent 4,6-di-amino-3-(prop-2-en-1-yl)-2-sulfanyl-idene-2,3-di-hydro-1,3,5-triazin-1-ium cations and two chloride anions. The propene groups assume different conformations in the two cations. The two independent cations are linked by two N-H⋯N hydrogen bonds, forming R 2 2(8) motifs. These hydrogen-bonded cation pairs are in turn bridged by the chloride anions through N-H⋯Cl contacts to neighbouring pairs.

    2026
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    3Crystal Structure and Hirshfeld Surface Analysis of 6-Bromo-2-(penta-fluoro-phen-yl)-2,3,7,7a-tetra-hydro-3a,6-ep-oxy-isoindol-1(6h)-one.
    Viktoria S Maslova, Veronika M Cherepanova,Victor N Khrustalev,Mehmet Akkurt, Gizachew Mulugeta Manahelohe, Khudayar I Hasanov,Narmina A Guliyeva

    In the crystal, enanti-omeric mol-ecules of C14H7BrF5NO2 are linked by C-H⋯O hydrogen bonds, forming layers parallel to the (101) plane. In addition, C-H⋯π inter-actions and Br⋯π contacts create layers parallel to the (101) plane. According to Hirshfeld surface analysis, the most important contributions to the crystal packing are F⋯H / H⋯F (32.4%), O⋯H / H⋯O (12.4%), F⋯F (11.5%), Br⋯F / F⋯Br (8.4%) and C⋯H / H⋯C (8.4%) inter-actions.

    2026
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    4Structure of Bis-(Tetra-ethyl-ammonium) Molybdate Dihydrate Obtained by the Reaction Between Ammonium Molybdate and Tetra-Ethyl-ammonium Hydroxide.
    P A S N P Jayawardena, Teodore J Melnyczuk-Gould, A M Buddhika Chandima,Stanislav Groysman,Cassandra L Ward

    Treatment of ammonium molybdate with tetra-ethyl-ammonium hydroxide produces tetra-ethyl-ammonium molybdate that can be recrystallized from aceto-nitrile/ether. The crystal structure reveals the dihydrate compound (C8H20N)2[MoO4]·2H2O. The presence of water mol-ecules in the structure is further supported by FTIR, which demonstrates the corresponding broad signal centered around 3225 cm-1. The supra-molecular structure of (Et4N)2[MoO4]·2H2O demonstrates two-dimensional layers of tetra-hedral molybdate mol-ecules bridged by water mol-ecules, with each Mo-oxo serving as a hydrogen-bond acceptor. The molybdate/water layers are spaced by the layers of disordered tetra-ethyl-ammonium counter-ions. The structural parameters of (Et4N)2[MoO4]·2H2O are presented at 100 and 200 K.

    2026
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    5Crystal Structure of the 'missing' Inter-Metallic Compound BaCu5.
    Kiran Avinash, Justin Andrews

    The copper-rich inter-metallic compounds CaCu5 and SrCu5 are isostructural but the isomorphous compound BaCu5 (barium penta-copper) has not been reported. The absence of any compound with the composition of BaCu5 in the Ba-Cu phase diagram has previously been attributed to much larger radius of Ba. The structure of BaCu5, which crystallizes in an ortho-rhom-bic cell (space group Pnma) with the rare SrZn5 structure type is now reported The structure is characterized by a zigzag arrangement of infinite Ba chains ensconced in a Cu matrix. The Ba atom and three Cu atoms lie on special positions with m site symmetry and one Cu atom lies on a general crystallographic position.

    2026
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    高被引作者

    作者引用发文
    Anthony L. Spek12511
    Edward R. T. Tiekink1183140
    Mukesh M. Jotani95272
    Mehmet Akkurt620231
    Necmi Dege60896
    Sang Loon Tan58822
    Joel Mague488140
    Mohamed Saadi31961
    Lahcen El Ammari31861
    El Mokhtar Essassi31865

    高产作者

    作者引用发文
    Mehmet Akkurt620231
    Joel Mague488140
    Edward R. T. Tiekink1183140
    Tuncer Hökelek296120
    Christian Näther166110
    Necmi Dege60896
    Ajaya Bhattarai12475
    Hemmige S Yathirajan23873
    Victor N. Khrustalev26072
    Mukesh M. Jotani95272

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