Citation: LI Wei-Dong, FANG Xu, QIAO Rui, CHEN Shui-Sheng. Non-covalent Bonded 3D Supramolecular Architectures Based on Acid-base Adducts[J]. Chinese Journal of Structural Chemistry, ;2016, 35(1): 46-54. doi: 10.14102/j.cnki.0254-5861.2011-0805 shu

Non-covalent Bonded 3D Supramolecular Architectures Based on Acid-base Adducts

1.
College of Chemistry & Chemical Engineering, Fuyang Normal College, Fuyang 236041, China

Received Date: 1 May 2015
Available Online: 24 September 2015
Fund Project:

Two novel acid-base adducts, [H₂L₁²⁺](Hpbda)₂ (1, L₁ = 1,4-di(1H-imidazol-4-yl) benzene, H₂pbda = 1,4-benzenedicarboxylic acid) and [H₂L₂²⁺](NO₃)₂ (2, L₂ = 1,4-di(1-carboxy- methyl-imidazol-4-yl)benzene), have been prepared and characterized by single-crystal X-ray diffraction, IR spectroscopy and elemental analysis. Compound 1 crystallizes in monoclinic, space group P2₁/n with a = 5.3525(11), b = 9.1471(19), c = 19.314(4) Å, β = 92.342(3)°, V = 944.8(3) Å³, Z = 2, C₁₆H₁₆N₆O₁₀, M_r = 452.35, D_c = 1.590 g/cm³, μ = 0.135 mm^-1, S = 1.058, F(000) = 468, the final R = 0.0661 and wR = 0.1887 for 2298 observed reflections (I > 2σ(I)). Compound 2 crystallizes in monoclinic, space group P2₁/c with a = 9.6923(10), b = 17.2950(17), c = 7.1880(7) Å, β = 94.801(2)°, V = 1200.7(2) Å³, Z = 2, C₂₈H₂₂N₄O₈, M_r = 542.50, D_c = 1.501 g/cm³, μ = 0.112 mm^-1, S = 1.060, F(000) = 564, the final R = 0.0394 and wR = 0.1017 for 2768 observed reflections (I > 2σ(I)). In the title compounds, both of L₁ and L₂ ligands act as weak base to accept protons to exhibit diprotonated H₂L₁²⁺ and H₂L₂²⁺ form, which can effectively employ as hydrogen bonding donors to combine anion moieties to form binary adducts respectively. In the crystal packing diagram of two polymers, there exist extensive noncovalent interactions including charge-transfer interactions, C(N)-H…π and N-H…O, C-H…O, O-H…O hydrogen bonding interactions between co-crystal moieties which consolidate the structures of supramolecular polymers, thus generating three-dimensional (3D) frameworks.
- synthesis,
- acid-base adducts,
- crystal structure,
- noncovalent interactions
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沈阳化工大学材料科学与工程学院沈阳 110142