Citation: HU Jin-Yan, SUN Hui-Min, GE Rong-Chen, YAN Ji-Tong, HUANG Wei-Wei. Supramolecular Network Obtained from the Interaction of Dihydrophosphate Anions and Thiourea-based Receptors[J]. Chinese Journal of Structural Chemistry, ;2016, 35(8): 1283-1288. doi: 10.14102/j.cnki.0254-5861.2011-1083 shu

Supramolecular Network Obtained from the Interaction of Dihydrophosphate Anions and Thiourea-based Receptors

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a College of Environmental and Chemical Engineering, Yanshan University, Qinhuangdao 066000, China;
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b Department of Mechanical and Electrical Engineering, Qinhuangdao Institute of Technology, Qinhuangdao 066000, China

Received Date: 10 December 2015
Available Online: 12 April 2016
Fund Project: This project was supported by the China Postdoctoral Science Foundation (No. 2014M551053) (No. 2014M551053) Natural Science Foundation of Hebei Province (No. B2015203124) (No. B2015203124)Key Laboratory of Advanced Energy Materials Chemistry (Ministry of Education) (Ministry of Education)

Two crystals of receptor 1, C₄₂H₅₂N₁₀O₄S₂ (anthracene-9,10-dicarbaldehyde bis-(phenyl-semithiocarbazone)) and 1-H₂PO₄^-, C₆₈H₁₁₄N₁₀O₁₀P₂S₂ were obtained at room temperature successfully, and their structures were characterized by X-ray crystallography diffraction. X-ray diffraction reveals that, receptor 1 crystallizes in monoclinic, space group P2₁/c, with a=9.487(3), b=20.674(6), c=11.821(4)Å, β=113.416(8)°, M_r=825.06, V=2127.5(12)Å³, Z=2, D_c=1.288 g/cm³, μ=0.18 mm^-1, F(000)=876, MoKα radiation (λ=0.71073Å), the final R=0.0472 and wR=0.0930. A total of 3758 unique reflections were collected, of which 3313 with I>2σ(I) were observed. Compound 1-H₂PO₄^- crystallizes in triclinic, space group P2₁/n, with a=8.767(1), b=13.6190(15), c=16.615(2)Å, α=98.727(14), β=103.061(14), γ=91.382(16)°, M_r=1357.75, V=1906.6 (4)Å³, Z=1, D_c=1.183 g/cm³, μ=0.17 mm^-1, F(000)=734, MoKα radiation (λ=0.71073Å), the final R=0.0769 and wR=0.1884. A total of 6699 unique reflections were collected, of which 2989 with I>2σ(I) were observed. As it was observed in the crystal structure of 1-H₂PO₄^-, 1 bound H₂PO₄^- at a 1:2 ratio by intermolecular interaction of N-H…O hydrogen bond obviously. Another interesting feature was that H₂PO₄^- groups assembled chains themselves via intramolecular hydrogen bond O-H…O and connected the 1 molecules together through the interaction of H-bonds, which improved the planarity of 1 and increased the stability of the entire structure.
- supramolecular network,
- crystal structure,
- thiourea,
- hydrogen bond
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