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首页> 外文期刊>Journal of chemical crystallography >Hydrogen Bonded 3D Supramolecular Architectures of Two Organic Salts Assembled from 2-Aminoheterocyclic Compounds and Phosphoric Acid
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Hydrogen Bonded 3D Supramolecular Architectures of Two Organic Salts Assembled from 2-Aminoheterocyclic Compounds and Phosphoric Acid

机译:由2-氨基杂环化合物和磷酸组装的两种有机盐的氢键3D超分子体系结构

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摘要

Two phosphate salts (2-aminopyrimidine): (phosphoric acid): H_2 O [HL1~+ (H_2 PO_4)~?]·H_2 O (1), and (4-phenylthiazol-2-amine): (phosphoric acid) [HL2~+ ·(H_2 PO_4)~?] (2) based on 2-aminoheterocyclic compounds, 2-aminopyrimidine (L1), and 4-phenylthiazol-2-amine (L2) were prepared and structurally characterized by X-ray crystallography. Compound 1 crystallizes in the triclinic, space group P-1, with a = 6.2201(7) ?, b = 8.6139(9) ?, c = 9.4800(10) ?, α = 109.685(2)°, β = 106.3340(10)°, γ = 95.4450(10)°, V = 448.72(8) ?~3, Z = 2. For 1, the cations were linked to each other via intermolecular C-H···N hydrogen bonds to form a 1-D chain structure running along the a-axis direction. The anions and the water molecules were connected alternatively along the a-axis direction through O-H···O hydrogen bonds to form a 1-D chain also. The cationic chains and the anionic chains were alternatively connected along the c-axis direction through N-H···O and C-H···O hydrogen bonds to form a 2D corrugated sheet. Adjacent sheets were combined together through π-π interaction to form double sheet. These double sheets were further joined together by O-H···O and N-H···O hydrogen bonds to produce a 3D network structure. Compound 2 crystallizes in the Orthorhombic, space group Pbca, with a = 10.1929(10) ?, b = 8.4406(9) ?, c = 27.589(2) ?, α = 90°, β = 90°, γ = 90°, V = 2373.6(4) ?~3, Z = 8. In 2, the phosphates formed 1D chain along the b-axis through two P-O-H···O = P hydrogen bonds. The cations formed 1D zigzag chain along the b-axis direction under the CH-π interaction. The anionic chains were intercalated between two adjacent cationic chains through N-H···O, O-H···O, C-H···O, and O-S contacts. Such stacking repeated along the c-axis direction to form a 3D network structure. Graphical Abstracts Due to the weak interactions, the complex displays 3D network structure.
机译:两种磷酸盐(2-氨基嘧啶):(磷酸):H_2 O [HL1〜+(H_2 PO_4)〜α]·H_2 O(1)和(4-苯基噻唑-2-胺):(磷酸)[制备了基于2-氨基杂环化合物,2-氨基嘧啶(L1)和4-苯基噻唑-2-胺(L2)的HL2 +·(H_2PO_4)-α](2),并通过X射线晶体学对其结构进行了表征。化合物1在三斜晶系空间群P-1中结晶,a = 6.2201(7)α,b = 8.6139(9)α,c = 9.4800(10)α,α= 109.685(2)°,β= 106.3340( 10)°,γ= 95.4450(10)°,V = 448.72(8)α〜3,Z =2。对于1,阳离子通过分子间CH···N氢键相互连接形成1- D链结构沿a轴方向延伸。阴离子和水分子通过O-H··O氢键沿a轴方向交替连接,也形成一维链。阳离子链和阴离子链通过N-H··O和C-H···O氢键沿c轴方向交替连接,从而形成二维波纹片。相邻的薄片通过π-π相互作用合并在一起,形成双薄片。这些双片通过O-H··O和N-H···O氢键进一步结合在一起以产生3D网络结构。化合物2在正交空间组Pbca中结晶,a = 10.1929(10)α,b = 8.4406(9)α,c = 27.589(2)α,α= 90°,β= 90°,γ= 90° ,V = 2373.6(4)≤3,Z = 8。在2中,磷酸酯通过两个POH···O = P氢键沿b轴形成一维链。阳离子在CH-π相互作用下沿b轴方向形成一维锯齿形链。阴离子链通过N-H··O,O-H···O,C-H···O和O-S接触插入两个相邻的阳离子链之间。这样的堆叠沿着c轴方向重复以形成3D网络结构。图形摘要由于交互作用较弱,因此复杂的显示器显示3D网络结构。

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