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Updated: Jun 4, 2026

Discovery and Synthesis Optimization of Isoreticular Al(III) Phosphonate-Based Metal-Organic Framework Compounds Using High-Throughput Methods
Published on: October 6, 2023
Open-framework aluminoborates co-templated by two types of primary amines
Gao-Juan Cao1, Jian Lin, Wei-Hui Fang
1State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian 350002, P. R. China.
Four novel open-framework aluminoborates (ABOs) were synthesized using primary amines. One structure exhibits noncentrosymmetric channels and second harmonic generation (SHG) properties, demonstrating potential for nonlinear optical applications.
Area of Science:
- Materials Chemistry
- Inorganic Chemistry
- Crystal Engineering
Background:
- Open-framework aluminoborates (ABOs) are an emerging class of materials with diverse potential applications.
- The rational design and synthesis of novel ABO structures with specific properties remain a key challenge in materials science.
Purpose of the Study:
- To synthesize and characterize a series of novel open-framework aluminoborates (ABOs) using co-templating primary amines.
- To investigate the structural diversity and nonlinear optical (NLO) properties of the synthesized ABOs.
Main Methods:
- Solvothermal synthesis utilizing primary amine co-templates.
- Characterization techniques including elemental analysis, IR, TGA, UV-Vis, powder XRD, and single crystal XRD.
- Nonlinear optical (NLO) determination and electronic structure calculations.
Main Results:
- Four new aluminoborates (ABOs) were successfully synthesized and structurally characterized.
- Three compounds (1-3) are isostructural, exhibiting CrB(4) topology with layered structures.
- Compound 4 displays a noncentrosymmetric 3D framework with 8- and 14-ring channels and exhibits second harmonic generation (SHG) activity (0.5x KDP).
Conclusions:
- The co-templating strategy with primary amines is effective for constructing diverse ABO frameworks.
- Compound 4 represents a promising new material for nonlinear optical applications due to its noncentrosymmetric structure and SHG response.
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