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RESEARCH PAPER · Inorganic Chemistry · 2023

Target-Oriented Synthesis of Borate Derivatives Featuring Isolated [B3O3] Six-Membered Rings as Structural Features

Meng Cheng, Congcong Jin, Wenqi Jin, Xueling Hou

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Target-Oriented Synthesis of Borate Derivatives Featuring Isolated [B3O3] Six-Membered Rings as Structural FeaturesOriginalHydroxyfluorooxoborate (NH 4 )[C(NH 2 ) 3 ][B 3 O 3 F 4 (OH)] for exploring the effects of cation substitution on structure and optical properties26K 5 [B 3 O 3 F 4 (OH)] 2 (NO 3 ): the first hydroxyfluorooxoborate-nitrate with a short ultraviolet cutoff edge and large birefringence18Unveiling the Potential of B3O3 Nanoflake as Effective Transporter for the Antiviral Drug Favipiravir: Density Functional Theory Analysis15A nonlinear optical crystal with deep-ultraviolet transparency and appropriate birefringence achieved using π-conjugated confined [B 3 O 3 F 4 (OH)] 2−14NaB(OH) 3 CH 3 : a deep-ultraviolet optical crystal with unprecedented methyl-modified [B(OH) 3 CH 3 ] units6Two Hydroxyfluorooxoborates Achieving Deep‐Ultraviolet Cutoff Edges and Moderate Birefringence by Assembling Multi‐Anionic Groups6[B3O3F4(OH)]2–: A Versatile Hydroxyfluorooxoborate Heteroanion Producing Compounds with Highly Tunable Optical Anisotropy19Exploration of sensing behavior B3O3 quantum dot toward methyl halides; a quantum chemical approach3(C3N2H5)B3O3F2(OH)2: Realizing Large Birefringence via a Synergistic Effect between Anion F/OH‐Ratio Optimization and Cation Activation25Structural Evolution and Optical Properties of Hydroxyfluorooxoborates MM′2n-1[B3O3F4(OH)]n (M = K, Cs, and Rb; M′ = K, NH4, and Cs; n = 1, 2, and 3)12Engineered Integration of Diverse Functional Units Induces Multifunctionality in Malonate‐Borate Hybrids44Adsorption Tendency of Boron Oxide (B 24 O 24 ) Nanocarrier toward Some Nucleobases and Their Nucleoside-Based Anticancer Drugs: A Comparative Density Functional Theory Study3Triple Integration of π‐Conjugated Building Blocks: Unprecedented Assembly for Large Optical Anisotropy11Unveiling B3O3 nanosheets as effective sensors for SF4 and SF6 gases: DFT, QTAIM, and NBO insights2[C 3 N 2 H 5 ]B 7 O 10 F 2 : Demonstrating a New Hydrogen‐Bond‐Induced Intralayer Charge‐Balanced Structure Model with Large Birefringence3F−/OH− terminal modification of [B3O6] clusters: Constructing deep-ultraviolet hydroxyfluorooxoborates with tunable optical performance0Target-oriented molecularly imprinted polymers enable rapid ambient ionization mass spectrometric analysis of trace tetrachlorobisphenol a in environmental samples1Beryllium decorated B 3 O 3 nanosheet as efficient anode materials for lithium-ion batteries: DFT and AIMD study0Structural-Dynamic Synergy in Hydrogen-Bond Reconfiguration Enables Room-Temperature Tunable Nonlinear Optical Materials0Fluorination‐Driven Molecular Polarization Engineering in Hydroxyfluorooxoborates for Generating Strong Short‐Wavelength Nonlinear Optical Responses0

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  1. Hydroxyfluorooxoborate (NH 4 )[C(NH 2 ) 3 ][B 3 O 3 F 4 (OH)] for exploring the effects of cation substitution on structure and optical properties

    Chemical Communications · 2023-01-01

    Ziqi Chen, Fuming Li, Zhihua Yang, Shilie Pan, Miriding Mutailipu

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  2. K 5 [B 3 O 3 F 4 (OH)] 2 (NO 3 ): the first hydroxyfluorooxoborate-nitrate with a short ultraviolet cutoff edge and large birefringence

    Dalton Transactions · 2023-01-01

    Luyong Zhang, Shi‐Bin Wang, Fangfang Zhang, Zhihua Yang, Xueling Hou

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  3. Unveiling the Potential of B3O3 Nanoflake as Effective Transporter for the Antiviral Drug Favipiravir: Density Functional Theory Analysis

    Molecules · 2023-12-14

    Muhammad Nauman Zahid, Naveen Kosar, Hasnain Sajid, Khalid E. Ibrahim, Mansour Khalil Gatasheh, Tariq Mahmood

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  4. A nonlinear optical crystal with deep-ultraviolet transparency and appropriate birefringence achieved using π-conjugated confined [B 3 O 3 F 4 (OH)] 2−

    New Journal of Chemistry · 2024-01-01

    Tao Ouyang, Chen Xu, Shanshan Chen, Yanqiang Li, Xiaoying Shang, Zhiyong Bai, Ningtao Jiang, Zhishuo Yan, Junhua Luo, Sangen Zhao

    Read original paper ↗ ·

  5. NaB(OH) 3 CH 3 : a deep-ultraviolet optical crystal with unprecedented methyl-modified [B(OH) 3 CH 3 ] units

    Journal of Materials Chemistry C · 2024-01-01

    Chenhui Hu, Huimin Li, Jian Wei Han, Xueling Hou, Zhihua Yang, Shilie Pan

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  6. Two Hydroxyfluorooxoborates Achieving Deep‐Ultraviolet Cutoff Edges and Moderate Birefringence by Assembling Multi‐Anionic Groups

    Chemistry - A European Journal · 2024-04-15

    Huanhuan Cheng, Xiaojing Li, Shilie Pan, Shilie Pan, Zhihua Yang

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  7. [B3O3F4(OH)]2–: A Versatile Hydroxyfluorooxoborate Heteroanion Producing Compounds with Highly Tunable Optical Anisotropy

    Chemistry of Materials · 2024-07-09

    Zeen Li, Congcong Jin, Changyou Liu, Juanjuan Lu, Zhihua Yang, Shilie Pan, Miriding Mutailipu

    Read original paper ↗ ·

  8. Exploration of sensing behavior B3O3 quantum dot toward methyl halides; a quantum chemical approach

    Computational and Theoretical Chemistry · 2024-07-22

    Naveen Kosar, Tariq Mahmood, Muhammad Adnan, Mohammed Salim Akhter, Mohammad Z. Ahmed, M. Raja

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  9. (C3N2H5)B3O3F2(OH)2: Realizing Large Birefringence via a Synergistic Effect between Anion F/OH‐Ratio Optimization and Cation Activation

    Small Structures · 2024-07-28

    Chenhui Hu, Chunjie Shen, Huan Zhou, Jian Wei Han, Zhihua Yang, Kenneth Reinhard Poeppelmeier, Feng Zhang, Shilie Pan

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  10. Structural Evolution and Optical Properties of Hydroxyfluorooxoborates MM′2n-1[B3O3F4(OH)]n (M = K, Cs, and Rb; M′ = K, NH4, and Cs; n = 1, 2, and 3)

    Chemistry of Materials · 2024-11-25

    Huan Pei, Luyong Zhang, Huanhuan Cheng, Shi‐Bin Wang, Zhihua Yang, Fangfang Zhang, Shilie Pan

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  11. Engineered Integration of Diverse Functional Units Induces Multifunctionality in Malonate‐Borate Hybrids

    Aggregate · 2025-08-18

    Ziqi Chen, Chenxu Li, Xiaoyu Wu, Juanjuan Lu, Zhihua Yang, Xueling Hou, Miriding Mutailipu

    Read original paper ↗ ·

  12. Adsorption Tendency of Boron Oxide (B 24 O 24 ) Nanocarrier toward Some Nucleobases and Their Nucleoside-Based Anticancer Drugs: A Comparative Density Functional Theory Study

    ACS Omega · 2025-09-28

    Al‐shimaa S. M. Rady, Peter A. Sidhom, Lamiaa A. Mohamed, Khalid E. Ibrahim, Shahzeb Khan, Mahmoud A. A. Ibrahim

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  13. Triple Integration of π‐Conjugated Building Blocks: Unprecedented Assembly for Large Optical Anisotropy

    Small · 2025-10-07

    Ruyi Niu, Xiaona Li, Zhihua Yang, Juanjuan Lu, Xueling Hou, Shujuan Han, Shilie Pan, Miriding Mutailipu

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  14. Unveiling B3O3 nanosheets as effective sensors for SF4 and SF6 gases: DFT, QTAIM, and NBO insights

    Surfaces and Interfaces · 2025-11-20

    Zaki Safi, Авни Бериша, Nuha Ahmed Wazzan

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  15. [C 3 N 2 H 5 ]B 7 O 10 F 2 : Demonstrating a New Hydrogen‐Bond‐Induced Intralayer Charge‐Balanced Structure Model with Large Birefringence

    Small · 2026-02-20

    Chunjie Shen, Huan Zhou, Zhihua Yang, Xueling Hou, Feng Zhang, Shilie Pan

    Read original paper ↗ ·

  16. F−/OH− terminal modification of [B3O6] clusters: Constructing deep-ultraviolet hydroxyfluorooxoborates with tunable optical performance

    Materials Today Chemistry · 2026-05-06

    Dahong Peng, Hongkang Su, Ziting Yan, chenxu li, Shilie Pan, Min Zhang

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  17. Target-oriented molecularly imprinted polymers enable rapid ambient ionization mass spectrometric analysis of trace tetrachlorobisphenol a in environmental samples

    Journal of Hazardous Materials · 2026-05-10

    Ya Jiao, Shuo Gao, Xiaoxuan Han, Yong Tian, Xiaoxu Huo, Jianwei Zhao, XiaoFeng Dong, Chunguang Liu, Weiliang Wang, Guifen Zhu, Xuwei Chen, Ming-li CHEN

    Read original paper ↗ ·

  18. Beryllium decorated B 3 O 3 nanosheet as efficient anode materials for lithium-ion batteries: DFT and AIMD study

    Journal of King Saud University - Science · 2026-06-18

    Nuha Ahmed Wazzan

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  19. Structural-Dynamic Synergy in Hydrogen-Bond Reconfiguration Enables Room-Temperature Tunable Nonlinear Optical Materials

    ACS Applied Optical Materials · 2026-10-06

    Zeen Li, Ziqi Chen, chenxu li, Min Zhang, Juanjuan Lu, Miriding Mutailipu

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  20. Fluorination‐Driven Molecular Polarization Engineering in Hydroxyfluorooxoborates for Generating Strong Short‐Wavelength Nonlinear Optical Responses

    Advanced Functional Materials · 2026-10-09

    Hongkang Su, Juhui Cui, chenxu li, Xiaona Li, Minqiang Gai, Zhihua Yang, Shilie Pan, Min Zhang

    Read original paper ↗ ·
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