Crystallography Open Database

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Searching year of publication is 2026

COD ID: 1576362
CIF file	Formula: - C57 H42 N6 O - Comments: Xia, Wen-Li; Ran, Xiaoyun; Zhao, Yu; Zhang, Hong; Zhou, Qian; Yu, Xiao-Qi; Li, Kun Fine-Tuning J-Aggregation via Steric Hindrance for High-Efficiency NIR-II Bioimaging and Photothermal Therapy Materials Horizons (2026) Space group: P 1 21/n 1 Cell volume: 4485.1 Cell parameters: 12.354; 19.366; 18.938; 90; 98.148; 90;

COD ID: 1576363
CIF file	Formula: - C36 H26 N6 - Comments: Xia, Wen-Li; Ran, Xiaoyun; Zhao, Yu; Zhang, Hong; Zhou, Qian; Yu, Xiao-Qi; Li, Kun Fine-Tuning J-Aggregation via Steric Hindrance for High-Efficiency NIR-II Bioimaging and Photothermal Therapy Materials Horizons (2026) Space group: C 1 2/c 1 Cell volume: 6074 Cell parameters: 28.97; 15.428; 14.241; 90; 107.4; 90;

COD ID: 1576403

CIF file

Formula: - C13 H12 Cl4 N Sb -
Comments: Zhao, Yuan-Yuan; Chen, Jian-Cheng; Zhang, Li; Chen, Jiabin; Liao, Qing; Li, Zhong-Qiu; Lin, Meijin; Yao, Jiannian; Zhong, Yu-Wu A pyridinium cation engineering strategy to achieve high-performance X-ray scintillation of antimony halides Chemical Science (2026)
Space group: P 1 21/c 1
Cell volume: 1612
Cell parameters: 16.746; 12.8783; 7.5195; 90; 96.248; 90;

COD ID: 1576404

CIF file

Formula: - C24 H22 Cl5.01 N4 O2 Sb -
Comments: Zhao, Yuan-Yuan; Chen, Jian-Cheng; Zhang, Li; Chen, Jiabin; Liao, Qing; Li, Zhong-Qiu; Lin, Meijin; Yao, Jiannian; Zhong, Yu-Wu A pyridinium cation engineering strategy to achieve high-performance X-ray scintillation of antimony halides Chemical Science (2026)
Space group: P -1
Cell volume: 1311.6
Cell parameters: 6.9093; 12.2402; 16.5732; 104.076; 101.79; 96.385;

COD ID: 1576405

CIF file

Formula: - C37.5 H53.74 Cl3 F3 N7.75 O3.25 Rh2 S -
Comments: Yan, Liping; Moriyama, Takumi; Akita, Yutaro; Muratsugu, Satoshi; Tada, Mizuki; Yamashita, Makoto; Morimoto, Yuma Low-oxidation state dirhodium complex produced by four-electron reduction of dirhodium(ii) complex supported by a flexible macrocyclic ligand Chemical Science (2026)
Space group: P 1 21/c 1
Cell volume: 4473.53
Cell parameters: 17.9664; 15.6304; 16.1234; 90; 98.88; 90;

COD ID: 1576406

CIF file

Formula: - C48 H64 F12 N12 O12 Rh2 S4 -
Comments: Yan, Liping; Moriyama, Takumi; Akita, Yutaro; Muratsugu, Satoshi; Tada, Mizuki; Yamashita, Makoto; Morimoto, Yuma Low-oxidation state dirhodium complex produced by four-electron reduction of dirhodium(ii) complex supported by a flexible macrocyclic ligand Chemical Science (2026)
Space group: P 1 21/n 1
Cell volume: 6338.3
Cell parameters: 11.588; 20.6879; 27.049; 90; 102.188; 90;

COD ID: 1576407

CIF file

Formula: - C36 H56 N6 O Rh2 -
Comments: Yan, Liping; Moriyama, Takumi; Akita, Yutaro; Muratsugu, Satoshi; Tada, Mizuki; Yamashita, Makoto; Morimoto, Yuma Low-oxidation state dirhodium complex produced by four-electron reduction of dirhodium(ii) complex supported by a flexible macrocyclic ligand Chemical Science (2026)
Space group: P 1 21/n 1
Cell volume: 7002.3
Cell parameters: 18.9151; 10.8332; 34.3806; 90; 96.308; 90;

COD ID: 1576408

CIF file

Formula: - C40 H64 N6 O Rh2 -
Comments: Yan, Liping; Moriyama, Takumi; Akita, Yutaro; Muratsugu, Satoshi; Tada, Mizuki; Yamashita, Makoto; Morimoto, Yuma Low-oxidation state dirhodium complex produced by four-electron reduction of dirhodium(ii) complex supported by a flexible macrocyclic ligand Chemical Science (2026)
Space group: P -1
Cell volume: 959.88
Cell parameters: 9.7299; 9.942; 11.2199; 107.213; 91.691; 110.555;

COD ID: 1576410

CIF file

Formula: - K0.67 O4 Sc0.67 Te1.33 -
Comments: Wang, Xiaoxu; Zhang, Tinghui; Zhao, Huijian; Jia, Ning; Liu, Hongjun; Ye, Ning; Hu, Zhanggui; Li, Conggang Tailoring ordered structures with distorted [TeO3] and aligned [ScO6] motifs for balanced nonlinear optical properties in rare-earth tellurate crystals Chemical Science (2026)
Space group: P 63 m c
Cell volume: 336.1
Cell parameters: 5.7988; 5.7988; 11.5416; 90; 90; 120;

COD ID: 1576411

CIF file

Formula: - O4 P0 Rb0.67 Sc0.67 Te1.33 -
Comments: Wang, Xiaoxu; Zhang, Tinghui; Zhao, Huijian; Jia, Ning; Liu, Hongjun; Ye, Ning; Hu, Zhanggui; Li, Conggang Tailoring ordered structures with distorted [TeO3] and aligned [ScO6] motifs for balanced nonlinear optical properties in rare-earth tellurate crystals Chemical Science (2026)
Space group: P 63 m c
Cell volume: 347.69
Cell parameters: 5.8371; 5.8371; 11.7832; 90; 90; 120;

COD ID: 1576412
CIF file	Formula: - C26 H18 N4 O2 - Comments: Parbin, Minaz; Sivalingam, Vellaiyadevan; Venkatachalam, Ramkumar; Chand, Dillip Kumar Conformational Adaptability Enabled Higher-Order Self-Sorting Processes in Coordination Cages Chemical Science (2026) Space group: P 1 21/c 1 Cell volume: 999.15 Cell parameters: 18.9883; 4.9718; 10.9031; 90; 103.906; 90;

COD ID: 1576413
CIF file	Formula: - C96 H90 N22 O22 Pd2 - Comments: Parbin, Minaz; Sivalingam, Vellaiyadevan; Venkatachalam, Ramkumar; Chand, Dillip Kumar Conformational Adaptability Enabled Higher-Order Self-Sorting Processes in Coordination Cages Chemical Science (2026) Space group: P n m a Cell volume: 9515.3 Cell parameters: 35.3355; 21.0797; 12.7746; 90; 90; 90;

COD ID: 1576414
CIF file	Formula: - C126 H137 B2 F8 N15 O14 Pd2 S6 - Comments: Parbin, Minaz; Sivalingam, Vellaiyadevan; Venkatachalam, Ramkumar; Chand, Dillip Kumar Conformational Adaptability Enabled Higher-Order Self-Sorting Processes in Coordination Cages Chemical Science (2026) Space group: C 1 2/c 1 Cell volume: 12343.6 Cell parameters: 22.5648; 12.5886; 43.6132; 90; 94.89; 90;

COD ID: 1576415
CIF file	Formula: - C108 H106 N13 O12 Pd2 S3 - Comments: Parbin, Minaz; Sivalingam, Vellaiyadevan; Venkatachalam, Ramkumar; Chand, Dillip Kumar Conformational Adaptability Enabled Higher-Order Self-Sorting Processes in Coordination Cages Chemical Science (2026) Space group: P n m a Cell volume: 9533 Cell parameters: 37.422; 19.921; 12.7873; 90; 90; 90;

COD ID: 1576416

CIF file

Formula: - C45 H38 Cl2 F6 N2 O16 Pd2 -
Comments: Qiu, Qianfeng; Usuba, Junichi; Koay, Wai Lean; Oppenheimer, Vincent Conrad; Wu, Man Wai; Zheng, Shao-Liang; Truong, Vinh Xuan; Han, Grace G. D. Visible Photon Energy Storage by [2+2] Cycloaddition of Pd-Oxazolones Chemical Science (2026)
Space group: P -1
Cell volume: 2337.06
Cell parameters: 8.6194; 14.7562; 19.1239; 98.4574; 100.39; 97.2586;

COD ID: 3500149
CIF file HKL data	Formula: - C12 H10 O - Comments: Thierry Maris Non spherical atom form-factors refinement of 4-Hydroxybiphenyl Personal communication to COD (2026) Space group: P 1 21/c 1 Cell volume: 853.02 Cell parameters: 19.9626; 5.4251; 7.9004; 90; 94.46; 90;

COD ID: 3500150
CIF file HKL data	Formula: - Br H5 N2 - Comments: Thierry Maris Hydrazinium Bromide at 150 K Personal communication to COD (2026) Space group: C 1 2/c 1 Cell volume: 650.41 Cell parameters: 12.7636; 4.5286; 12.0133; 90; 110.499; 90;

COD ID: 7064146
CIF file	Formula: - C33 H29 Br Cl2 Fe Mn N2 O3 P - Comments: Yang, Runqian; Bandyopadhyay, Uchchhal; Mallet-Ladeira, Sonia; Poli, Rinaldo; Manoury, Eric; Labande, Agnès Asymmetric hydrogenation of ketones with planar chiral manganese(i) complexes New Journal of Chemistry (2026) Space group: P 21 21 21 Cell volume: 6543.03 Cell parameters: 14.7584; 15.3917; 28.804; 90; 90; 90;

COD ID: 7064147

CIF file

Formula: - C67 H60 Br4 Cl2 Fe2 Mn3 N4 O8 P2 -
Comments: Yang, Runqian; Bandyopadhyay, Uchchhal; Mallet-Ladeira, Sonia; Poli, Rinaldo; Manoury, Eric; Labande, Agnès Asymmetric hydrogenation of ketones with planar chiral manganese(i) complexes New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 3971.86
Cell parameters: 13.9449; 14.3934; 22.7282; 83.071; 89.592; 61.467;

COD ID: 7064148

CIF file

Formula: - C46 H60 N2 O10 -
Comments: Parmar, Binal B.; Abraham, Alex; Butcher, Raymond J.; Bedekar, Ashutosh Synthesis of chiral cyclohexanol derived benzylamines, applications for enantiodiscrimination of optically active analytes by NMR spectroscopy New Journal of Chemistry (2026)
Space group: P 61
Cell volume: 6466.99
Cell parameters: 10.9923; 10.9923; 61.8008; 90; 90; 120;

COD ID: 7064149

CIF file

Formula: - C63 H58 Cl N2 O9 P2 Rh -
Comments: Shao, Tai-ming; Liao, Hai-Xia; Li, Qiu-Ming; Tan, Mingxiong; Liang, Chun-Jie; Liang, Hong; Qin, Qi-Pin Designing mitophagy-targeted robustine- and 4-acridinol-rhodium(III) coordination compounds to overcome cisplatin resistance in A549/DDP lung cancer cells New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 2733.48
Cell parameters: 11.7749; 13.8665; 18.1394; 96.868; 99.566; 107.863;

COD ID: 7064150

CIF file

Formula: - C44 H31 Cl N2 O2 P Rh -
Comments: Shao, Tai-ming; Liao, Hai-Xia; Li, Qiu-Ming; Tan, Mingxiong; Liang, Chun-Jie; Liang, Hong; Qin, Qi-Pin Designing mitophagy-targeted robustine- and 4-acridinol-rhodium(III) coordination compounds to overcome cisplatin resistance in A549/DDP lung cancer cells New Journal of Chemistry (2026)
Space group: I 1 2/a 1
Cell volume: 7157
Cell parameters: 15.946; 18.321; 24.503; 90; 90.963; 90;

COD ID: 7064151

CIF file

Formula: - C26 H24 N O Si -
Comments: Takii, Masaomi; Nishiura, Fumiteru; Yao, Masaru; Inoue, Hidenari; Miura, Youhei; Yoshioka, Naoki Synthesis and Magnetic Properties of 2,2-Diphenyl-1,2-dihydroquinoline N-Oxyl Carrying Ethynyl Group at 5-Position New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 2179.99
Cell parameters: 10.8542; 9.0975; 22.1134; 90; 93.299; 90;

COD ID: 7064152
CIF file	Formula: - C23 H16 N O - Comments: Takii, Masaomi; Nishiura, Fumiteru; Yao, Masaru; Inoue, Hidenari; Miura, Youhei; Yoshioka, Naoki Synthesis and Magnetic Properties of 2,2-Diphenyl-1,2-dihydroquinoline N-Oxyl Carrying Ethynyl Group at 5-Position New Journal of Chemistry (2026) Space group: P 21 21 21 Cell volume: 1645.51 Cell parameters: 9.7866; 12.2573; 13.7175; 90; 90; 90;

COD ID: 7064153
CIF file	Formula: - C23 H16 N O - Comments: Takii, Masaomi; Nishiura, Fumiteru; Yao, Masaru; Inoue, Hidenari; Miura, Youhei; Yoshioka, Naoki Synthesis and Magnetic Properties of 2,2-Diphenyl-1,2-dihydroquinoline N-Oxyl Carrying Ethynyl Group at 5-Position New Journal of Chemistry (2026) Space group: P 21 21 21 Cell volume: 1642.53 Cell parameters: 12.2498; 13.7016; 9.7862; 90; 90; 90;

COD ID: 7064154

CIF file

Formula: - C33 H28 O -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: C m c 21
Cell volume: 9401.15
Cell parameters: 50.4688; 10.73782; 17.3477; 90; 90; 90;

COD ID: 7064155

CIF file

Formula: - C76 H64 N2 Na2 O2 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 2939.54
Cell parameters: 12.5132; 18.0414; 13.3588; 90; 102.914; 90;

COD ID: 7064156

CIF file

Formula: - C81 H69 Li2 N3 O2 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1530.92
Cell parameters: 11.1331; 11.7087; 11.9357; 86.021; 83.123; 83.042;

COD ID: 7064157

CIF file

Formula: - C42 H48 Li N3 O -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1715.47
Cell parameters: 8.9421; 11.338; 18.022; 74.276; 81.494; 78.602;

COD ID: 7064158

CIF file

Formula: - C96 H84 Li2 N6 O2 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: C 1 2/c 1
Cell volume: 7605.05
Cell parameters: 27.85728; 17.91332; 15.50682; 90; 100.643; 90;

COD ID: 7064159

CIF file

Formula: - C74 H70 K2 O4 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1445.5
Cell parameters: 10.7669; 11.3608; 12.8692; 90.457; 99.184; 111.163;

COD ID: 7064160

CIF file

Formula: - C76 H64 K2 N2 O2 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 3039.05
Cell parameters: 12.3599; 15.1436; 16.7657; 90; 104.433; 90;

COD ID: 7064161

CIF file

Formula: - C88 H86 Li2 O4 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 3427.44
Cell parameters: 10.8054; 14.1131; 24.2657; 90.411; 94.438; 111.613;

COD ID: 7064162

CIF file

Formula: - C49 H59 Na O9 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 4246.04
Cell parameters: 13.1871; 19.1661; 17.4859; 90; 106.105; 90;

COD ID: 7064163

CIF file

Formula: - C74 H70 Na2 O4 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 2956.07
Cell parameters: 12.4199; 18.3706; 13.3175; 90; 103.379; 90;

COD ID: 7064164

CIF file

Formula: - C74 H70 K2 O4 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 2989.08
Cell parameters: 12.2267; 14.8345; 17.1733; 90; 106.337; 90;

COD ID: 7064165

CIF file

Formula: - C90 H103 K O11 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 7674.14
Cell parameters: 14.0182; 23.2391; 23.557; 90; 90.153; 90;

COD ID: 7064166

CIF file

Formula: - C45 H51 Na O7 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1944.57
Cell parameters: 11.0879; 13.4341; 14.7219; 80.838; 68.502; 72.663;

COD ID: 7064167

CIF file

Formula: - C88.24 H98.46 Li2 O7.56 -
Comments: Bardonov, Daniil; Nasyrova, Darina; Metlin, Mikhail T.; Minyaev, Mikhail E.; Taydakov, Ilya V.; Roitershtein, Dmitrii M. Synthesis, Structural and Photophysical Studies of Mono-and Dinuclear Alkali Metal 2,6-dibenzhydryl-4-methylphenolates New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 3634.59
Cell parameters: 10.7672; 27.4493; 12.3213; 90; 93.552; 90;

COD ID: 7064168

CIF file

Formula: - C20 H25 N3 O5 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P 21 21 21
Cell volume: 1958.22
Cell parameters: 7.823; 15.2957; 16.3651; 90; 90; 90;

COD ID: 7064169

CIF file

Formula: - C21 H27 N3 O6 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1093.89
Cell parameters: 9.4175; 10.0566; 12.3547; 78.091; 85.705; 72.853;

COD ID: 7064170

CIF file

Formula: - C19 H25 N5 O6 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1081.91
Cell parameters: 8.2408; 10.3384; 14.7449; 109.197; 91.635; 112.158;

COD ID: 7064171

CIF file

Formula: - C35 H34 Cl6 N4 O6 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1883.32
Cell parameters: 9.9781; 12.8763; 15.9233; 81.329; 75.973; 72.202;

COD ID: 7064172

CIF file

Formula: - C28 H28 Cl2 N4 O4 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1367.11
Cell parameters: 8.3578; 13.6138; 14.4275; 108.467; 104.556; 107.864;

COD ID: 7064173

CIF file

Formula: - C26 H24 N4 O4 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P 21 21 21
Cell volume: 2293.24
Cell parameters: 12.9825; 13.1403; 13.4427; 90; 90; 90;

COD ID: 7064174

CIF file

Formula: - C27 H29 N3 O4 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 2312.17
Cell parameters: 17.2384; 14.0947; 9.534; 90; 93.494; 90;

COD ID: 7064175

CIF file

Formula: - C26 H26 N4 O6 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P c a 21
Cell volume: 2365.94
Cell parameters: 12.99141; 14.05629; 12.95619; 90; 90; 90;

COD ID: 7064176

CIF file

Formula: - C136 H136.2 Cl17.37 N20 O35.2 Ru4 -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 3716.9
Cell parameters: 9.9817; 14.0691; 26.5049; 90; 93.04; 90;

COD ID: 7064177

CIF file

Formula: - C46 H53 N6 O8 Ru2 -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: C 1 2/m 1
Cell volume: 2177.42
Cell parameters: 13.3048; 13.5619; 12.1496; 90; 96.67; 90;

COD ID: 7064178

CIF file

Formula: - C26 H27 N3 O4 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P c a 21
Cell volume: 4612.91
Cell parameters: 17.2442; 12.159; 22.0006; 90; 90; 90;

COD ID: 7064179

CIF file

Formula: - C18 H21 N3 O5 Ru -
Comments: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 925.81
Cell parameters: 9.7789; 10.0997; 10.8427; 74.531; 64.202; 79.03;

COD ID: 7064180

CIF file

Formula: - C45 H61 N4 Nd O5 -
Comments: Massoud, Salah S.; Louka, Febee R.; Guizouarn, Thierry; Fischer, Roland C.; Torvisco, Ana; Mautner, Franz A.; Smith, Asia M.; Salem, Nahed M. H.; Velmurugan, Gunasekaran; Comba, Peter; Pointillart, Fabrice Structural and magnetic properties of lanthanide–tetraphenol–cyclen complexes: slow magnetic relaxation of the Nd(iii) complex New Journal of Chemistry (2026)
Space group: P c a 21
Cell volume: 4116.9
Cell parameters: 14.775; 12.4393; 22.4001; 90; 90; 90;

COD ID: 7064181

CIF file

Formula: - C45 H61 Ho N4 O5 -
Comments: Massoud, Salah S.; Louka, Febee R.; Guizouarn, Thierry; Fischer, Roland C.; Torvisco, Ana; Mautner, Franz A.; Smith, Asia M.; Salem, Nahed M. H.; Velmurugan, Gunasekaran; Comba, Peter; Pointillart, Fabrice Structural and magnetic properties of lanthanide–tetraphenol–cyclen complexes: slow magnetic relaxation of the Nd(iii) complex New Journal of Chemistry (2026)
Space group: P c a 21
Cell volume: 4167.9
Cell parameters: 14.9515; 12.4578; 22.3763; 90; 90; 90;

COD ID: 7064182

CIF file

Formula: - C40 H49 Cl4 Ho N4 O6 -
Comments: Massoud, Salah S.; Louka, Febee R.; Guizouarn, Thierry; Fischer, Roland C.; Torvisco, Ana; Mautner, Franz A.; Smith, Asia M.; Salem, Nahed M. H.; Velmurugan, Gunasekaran; Comba, Peter; Pointillart, Fabrice Structural and magnetic properties of lanthanide–tetraphenol–cyclen complexes: slow magnetic relaxation of the Nd(iii) complex New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 4107.9
Cell parameters: 13.1871; 18.6904; 17.053; 90; 102.217; 90;

COD ID: 7064183

CIF file

Formula: - C45 H61 Gd N4 O5 -
Comments: Massoud, Salah S.; Louka, Febee R.; Guizouarn, Thierry; Fischer, Roland C.; Torvisco, Ana; Mautner, Franz A.; Smith, Asia M.; Salem, Nahed M. H.; Velmurugan, Gunasekaran; Comba, Peter; Pointillart, Fabrice Structural and magnetic properties of lanthanide–tetraphenol–cyclen complexes: slow magnetic relaxation of the Nd(iii) complex New Journal of Chemistry (2026)
Space group: P c a 21
Cell volume: 4139.5
Cell parameters: 14.8229; 12.4491; 22.4326; 90; 90; 90;

COD ID: 7064184

CIF file

Formula: - C24 H17 Br2 Cu N2 O P -
Comments: Savinykh, P. E.; Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Sadykov, E. H.; Artem’ev, A. V.; Lider, E. V. Copper(ii) complexes with a hybrid phosphinyl-phenanthroline ligand: synthesis, crystal structures and effect of phosphinyl functionalization on the cytotoxicity New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 2263.6
Cell parameters: 12.6177; 15.4777; 12.2452; 90; 108.818; 90;

COD ID: 7064185

CIF file

Formula: - C52 H47 Cl4 Cu2 N4 O5 P2 -
Comments: Savinykh, P. E.; Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Sadykov, E. H.; Artem’ev, A. V.; Lider, E. V. Copper(ii) complexes with a hybrid phosphinyl-phenanthroline ligand: synthesis, crystal structures and effect of phosphinyl functionalization on the cytotoxicity New Journal of Chemistry (2026)
Space group: C 1 2/c 1
Cell volume: 4975.8
Cell parameters: 26.2356; 14.0647; 17.007; 90; 127.544; 90;

COD ID: 7064186

CIF file

Formula: - C34 H27 Cu N6 O8 P -
Comments: Savinykh, P. E.; Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Sadykov, E. H.; Artem’ev, A. V.; Lider, E. V. Copper(ii) complexes with a hybrid phosphinyl-phenanthroline ligand: synthesis, crystal structures and effect of phosphinyl functionalization on the cytotoxicity New Journal of Chemistry (2026)
Space group: P 1 21/n 1
Cell volume: 3259.7
Cell parameters: 10.4842; 29.141; 11.2189; 90; 108.009; 90;

COD ID: 7064187

CIF file

Formula: - C26 H33 Cl2 N7 Ni O8 -
Comments: Hu, Jinlin; Qi, Zhichao; Zhang, Lianghui; Liang, Xiangming; Lin, Junqi; Ruan, Zhijun; Liu, Shanshan Electrocatalytic water oxidation by nickel complexes: The effect of coordination number and ligand backbone structure on catalytic properties New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 3012.07
Cell parameters: 16.7337; 14.1267; 13.8407; 90; 112.985; 90;

COD ID: 7064188

CIF file

Formula: - C19 H31 Cl2 N5 Ni O10 -
Comments: Hu, Jinlin; Qi, Zhichao; Zhang, Lianghui; Liang, Xiangming; Lin, Junqi; Ruan, Zhijun; Liu, Shanshan Electrocatalytic water oxidation by nickel complexes: The effect of coordination number and ligand backbone structure on catalytic properties New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 2592.8
Cell parameters: 17.933; 8.9773; 17.496; 90; 112.996; 90;

COD ID: 7064189

CIF file

Formula: - C55 H92 B42 P2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 3634.03
Cell parameters: 12.7277; 13.6449; 21.3554; 90; 101.521; 90;

COD ID: 7064190

CIF file

Formula: - C11 H8 Cl3 F3 O -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 21 21 21
Cell volume: 1264.39
Cell parameters: 5.7645; 12.1514; 18.0507; 90; 90; 90;

COD ID: 7064191

CIF file

Formula: - C27 H51 B21 N2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 3692.5
Cell parameters: 11.4018; 19.0846; 17.3716; 90; 102.358; 90;

COD ID: 7064192

CIF file

Formula: - C12 H11 Cl4 N O2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 1441.94
Cell parameters: 11.9375; 13.5556; 9.6733; 90; 112.902; 90;

COD ID: 7064193

CIF file

Formula: - C12 H11 Cl3 N O2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 1358.77
Cell parameters: 10.7611; 14.019; 9.5719; 90; 109.786; 90;

COD ID: 7064194

CIF file

Formula: - C20 H16 Cl8 O2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: I 1 a 1
Cell volume: 2333.5
Cell parameters: 11.2258; 13.766; 15.1288; 90; 93.525; 90;

COD ID: 7064195

CIF file

Formula: - C15 H18 Cl3 N O2 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1688.77
Cell parameters: 9.2834; 11.5385; 16.7356; 76.702; 83.835; 75.793;

COD ID: 7064196

CIF file

Formula: - C48 H36 Br3 Cl9 O6 -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: R -3 :H
Cell volume: 7783.6
Cell parameters: 39.1114; 39.1114; 5.8755; 90; 90; 120;

COD ID: 7064197

CIF file

Formula: - C25 H41 B21 Cl2 F3 P -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1864.45
Cell parameters: 10.6621; 11.0433; 16.7913; 94.433; 106.841; 97.095;

COD ID: 7064198

CIF file

Formula: - C13 H36 B21 N -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P 21 21 21
Cell volume: 2621.8
Cell parameters: 15.269; 16.88; 10.1723; 90; 90; 90;

COD ID: 7064199

CIF file

Formula: - C29 H60 B21 F5 N P -
Comments: Sokolov, Vladislav A.; Bakulina, Olga; Boyarskaya, Irina A.; Spiridonova, Dar'ya V.; Kryukova, Mariya A.; Vasilyev, Aleksander Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various nucleophiles in CF3SO3H New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 2100.3
Cell parameters: 10.3795; 11.6288; 18.0566; 76.631; 82.103; 88.428;

COD ID: 7064200

CIF file

Formula: - C21 H31 Br2 Co N3 -
Comments: Das, Anjan; Mukhopadhyay, Titas Kumar; Maitra, Biswajit; Pal, Dibyendu; Mondal, Moumita A Comparison of Structure-Activity Relationships between Bis(imino)Pyridine Pincers of Nickel and Cobalt for Electrochemical Reduction of CO2 New Journal of Chemistry (2026)
Space group: P b c a
Cell volume: 4536.3
Cell parameters: 10.6905; 17.266; 24.5759; 90; 90; 90;

COD ID: 7064201

CIF file

Formula: - C21 H31 Br2 N3 Ni -
Comments: Das, Anjan; Mukhopadhyay, Titas Kumar; Maitra, Biswajit; Pal, Dibyendu; Mondal, Moumita A Comparison of Structure-Activity Relationships between Bis(imino)Pyridine Pincers of Nickel and Cobalt for Electrochemical Reduction of CO2 New Journal of Chemistry (2026)
Space group: P b c a
Cell volume: 4472.5
Cell parameters: 10.7374; 17.0804; 24.3869; 90; 90; 90;

COD ID: 7064202

CIF file

Formula: - C18 H26 Cu N4 O12 S2 -
Comments: He, Jiechen; Chen, Feirong; Lin, Chenxin; Chen, Yaozong; Liu, Lizhen; Yao, Zizhu Proton conductivity and dielectric anomalies in a chain-based metal-organic framework with a hydrogen-bonded network of [SO3] groups, pyrazine and water molecules New Journal of Chemistry (2026)
Space group: P 1 2/c 1
Cell volume: 2498.9
Cell parameters: 27.395; 6.8515; 13.3173; 90; 91.411; 90;

COD ID: 7064203
CIF file	Formula: - C42 H44 Cu Mo8 N12 O27 - Comments: Ge, Meng; Yu, Shuang; Yuan, Linyue; Zang, Hong-Ying Construction and proton conductivity of a POMs-based compound based on different isomers of [Mo8O26]4- ions New Journal of Chemistry (2026) Space group: P -1 Cell volume: 2949.2 Cell parameters: 11.1502; 13.1951; 21.366; 90.63; 102.445; 105.565;

COD ID: 7064204
CIF file	Formula: - C84 H114 Cu4 N16 Ni2 O13 P4 S12 - Comments: Chaturvedi, Nishtha; Pandey, Vinay Kumar; Tiwari, Vinod K.; Bhattacharya, Subrato Tunable Cu-Ni phosphine-thiolate complexes as water-compatible catalyst for base-free click chemistry New Journal of Chemistry (2026) Space group: P 4/n :2 Cell volume: 5417.47 Cell parameters: 17.9807; 17.9807; 16.7565; 90; 90; 90;

COD ID: 7064205
CIF file	Formula: - C43 H38 N4 Ni O P3 S6 - Comments: Chaturvedi, Nishtha; Pandey, Vinay Kumar; Tiwari, Vinod K.; Bhattacharya, Subrato Tunable Cu-Ni phosphine-thiolate complexes as water-compatible catalyst for base-free click chemistry New Journal of Chemistry (2026) Space group: P -1 Cell volume: 2368.11 Cell parameters: 8.3069; 14.2107; 20.9064; 96.525; 98.97; 100.841;

COD ID: 7064206
CIF file	Formula: - C85 H78.5 Cu2 N5.5 P6 S6 - Comments: Chaturvedi, Nishtha; Pandey, Vinay Kumar; Tiwari, Vinod K.; Bhattacharya, Subrato Tunable Cu-Ni phosphine-thiolate complexes as water-compatible catalyst for base-free click chemistry New Journal of Chemistry (2026) Space group: P -1 Cell volume: 2093.38 Cell parameters: 13.0359; 13.8734; 14.836; 117.864; 91.092; 113.985;

COD ID: 7064207

CIF file

Formula: - C15 H18 Cl2 Cu N3 O0.5 -
Comments: Ganesh, Yamuna; Devaraj , Karthickram; Palani, Narasimman; Bhuvanesh, Nattamai S. P.; Karuppasamy, Sundaravel Copper(II) Complexes of Dipica and Its Derivatives as Biomimetic Models for Phenoxazinone Synthase: Probing the Effect of Central N-cycloalkyl Rings on Reactivity New Journal of Chemistry (2026)
Space group: P -1
Cell volume: 1613.42
Cell parameters: 8.6151; 13.345; 14.503; 97.283; 102.476; 90.793;

COD ID: 7064208

CIF file

Formula: - C19 H25 Cl2 Cu N3 -
Comments: Ganesh, Yamuna; Devaraj , Karthickram; Palani, Narasimman; Bhuvanesh, Nattamai S. P.; Karuppasamy, Sundaravel Copper(II) Complexes of Dipica and Its Derivatives as Biomimetic Models for Phenoxazinone Synthase: Probing the Effect of Central N-cycloalkyl Rings on Reactivity New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 1949.3
Cell parameters: 11.8525; 13.3585; 13.5704; 90; 114.875; 90;

COD ID: 7064209

CIF file

Formula: - C17 H21 Cl2 Cu N3 -
Comments: Ganesh, Yamuna; Devaraj , Karthickram; Palani, Narasimman; Bhuvanesh, Nattamai S. P.; Karuppasamy, Sundaravel Copper(II) Complexes of Dipica and Its Derivatives as Biomimetic Models for Phenoxazinone Synthase: Probing the Effect of Central N-cycloalkyl Rings on Reactivity New Journal of Chemistry (2026)
Space group: P 1 21/c 1
Cell volume: 1697.86
Cell parameters: 8.016; 13.916; 15.2343; 90; 92.44; 90;

COD ID: 7064210
CIF file	Formula: - C7 H5 Cl2 N O Se - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/c 1 Cell volume: 854.74 Cell parameters: 3.9116; 15.1339; 14.4893; 90; 94.788; 90;

COD ID: 7064211
CIF file	Formula: - C24 H29 Br2 N3 O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/c 1 Cell volume: 2515.5 Cell parameters: 13.734; 9.677; 19.852; 90; 107.56; 90;

COD ID: 7064212
CIF file	Formula: - C14 H22 Br4 N2 O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P n m a Cell volume: 6452.4 Cell parameters: 14.9143; 26.7884; 16.15; 90; 90; 90;

COD ID: 7064213
CIF file	Formula: - C7 H5 Cl4 N O Se - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/n 1 Cell volume: 1157.45 Cell parameters: 7.9518; 16.465; 8.8983; 90; 96.536; 90;

COD ID: 7064214
CIF file	Formula: - C10 H10 Br3 N O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/c 1 Cell volume: 1424.2 Cell parameters: 9.158; 11.0228; 14.2654; 90; 98.511; 90;

COD ID: 7064215
CIF file	Formula: - C9 H9 Cl3 N2 O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P -1 Cell volume: 676.1 Cell parameters: 7.383; 8.447; 12.114; 107.25; 91.93; 108.787;

COD ID: 7064216
CIF file	Formula: - C15 H23 Br4 Cl3 N2 O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/c 1 Cell volume: 2505.7 Cell parameters: 14.1714; 9.0498; 19.5492; 90; 91.967; 90;

COD ID: 7064217
CIF file	Formula: - C12 H16 Br3.5 N1.5 O Te - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21 1 Cell volume: 1791.3 Cell parameters: 9.062; 12.768; 15.657; 90; 98.57; 90;

COD ID: 7064218
CIF file	Formula: - C34 H39 Br7 N4 O2 Te2 - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: C 1 2/c 1 Cell volume: 4273.1 Cell parameters: 24.6425; 13.1419; 13.636; 90; 104.617; 90;

COD ID: 7064219
CIF file	Formula: - C40 H36 I4 N4 O4 Te4 - Comments: MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati New Journal of Chemistry (2026) Space group: P 1 21/n 1 Cell volume: 4729.6 Cell parameters: 14.2144; 22.4896; 16.3097; 90; 114.888; 90;

COD ID: 7135279

CIF file

Formula: - C26 H32 O4 S -
Comments: Samantaray, Swati; Saha, Sharajit; Punniyamurthy, Tharmalingam Rh-catalyzed chemodivergent [4+1]-annulation/allylation of sulfoxonium ylides with α-methylene-β-lactones: access to α-indanonyl/α-benzyl acrylates Chemical Communications (2026)
Space group: P 1 21/c 1
Cell volume: 2447
Cell parameters: 21.4284; 10.2324; 11.5649; 90; 105.207; 90;

COD ID: 7135280

CIF file

Formula: - C17 H18 O3 -
Comments: Samantaray, Swati; Saha, Sharajit; Punniyamurthy, Tharmalingam Rh-catalyzed chemodivergent [4+1]-annulation/allylation of sulfoxonium ylides with α-methylene-β-lactones: access to α-indanonyl/α-benzyl acrylates Chemical Communications (2026)
Space group: P -1
Cell volume: 719.26
Cell parameters: 8.4589; 9.2758; 9.7016; 93.006; 108.39; 93.186;

COD ID: 7135284
CIF file	Formula: - C6 N1.5 O11.917 P0.333 W3 Zr0.5 - Comments: Liang, Zhijie; Yao, Yiqing; Ding, Yuyang; Wang, Haifeng; Li, Huafeng; Feng, Gang Stable Zr-based polyoxometalate as a green catalyst for selective oxidation of aniline Chemical Communications (2026) Space group: R -3 m :H Cell volume: 17497.9 Cell parameters: 22.6915; 22.6915; 39.2399; 90; 90; 120;

COD ID: 7135285
CIF file	Formula: - C34 H36 N4 O6 - Comments: Luan, Yu-Yong; Li, Jin-Ye; Liu, Xue-Yuan; Liang, Yong-Min Ru-Catalyzed C-H Annulation: Accessing Quinazolinone-BCP Hybrids from Stable Precursors Chemical Communications (2026) Space group: P -1 Cell volume: 1528.74 Cell parameters: 9.0582; 11.4917; 16.1874; 102.344; 104.774; 102.029;

COD ID: 7135286

CIF file

Formula: - C40 H59 Cl2 N2 P Ru -
Comments: Pontavatchai, Apicha; Schwedtmann, Kevin; Royla, Philipp; Schwedtmann, Kai; Khamnaen, Tossapol; Schwarzenbolz, Uwe; Henle, Thomas; Somsook, Ekasith; Weigand, Jan J. Chain-length-dependent reactivity of alkenyl phosphates in ruthenium-catalyzed cross-metathesis Chemical Communications (2026)
Space group: P 1 21/n 1
Cell volume: 3881.24
Cell parameters: 12.2189; 18.2929; 17.8873; 90; 103.89; 90;

COD ID: 7135289
CIF file	Formula: - C9 H18 B9 N O2 - Comments: Li, Xinrui; Zhou, Ningning; Tu, Deshuang; Lu, Chang-sheng; Yan, Hong Metal-free regioselective B–O coupling in carboranes for constructing aggregation-induced emission luminogens Chemical Communications (2026) Space group: P -1 Cell volume: 765.4 Cell parameters: 7.035; 9.707; 11.99; 97.167; 102.787; 102.826;

COD ID: 7135290
CIF file	Formula: - C13 H19 B9 N2 O2 - Comments: Li, Xinrui; Zhou, Ningning; Tu, Deshuang; Lu, Chang-sheng; Yan, Hong Metal-free regioselective B–O coupling in carboranes for constructing aggregation-induced emission luminogens Chemical Communications (2026) Space group: P 1 21/n 1 Cell volume: 1741.9 Cell parameters: 9.3624; 15.562; 12.4785; 90; 106.649; 90;

COD ID: 7135291
CIF file	Formula: - C14 H20 B9 N O2 - Comments: Li, Xinrui; Zhou, Ningning; Tu, Deshuang; Lu, Chang-sheng; Yan, Hong Metal-free regioselective B–O coupling in carboranes for constructing aggregation-induced emission luminogens Chemical Communications (2026) Space group: P -1 Cell volume: 896.7 Cell parameters: 6.5542; 10.0432; 14.4842; 79.901; 79.8; 74.684;

COD ID: 7135292
CIF file	Formula: - C7 H15 B9 Cl N - Comments: Li, Xinrui; Zhou, Ningning; Tu, Deshuang; Lu, Chang-sheng; Yan, Hong Metal-free regioselective B–O coupling in carboranes for constructing aggregation-induced emission luminogens Chemical Communications (2026) Space group: C 1 2/c 1 Cell volume: 2597.1 Cell parameters: 20.3463; 6.4323; 20.4209; 90; 103.65; 90;

COD ID: 7135293
CIF file	Formula: - C7 H14 B9 Cl2 N - Comments: Li, Xinrui; Zhou, Ningning; Tu, Deshuang; Lu, Chang-sheng; Yan, Hong Metal-free regioselective B–O coupling in carboranes for constructing aggregation-induced emission luminogens Chemical Communications (2026) Space group: C 1 2/c 1 Cell volume: 2817.8 Cell parameters: 20.226; 7.0287; 19.947; 90; 96.446; 90;

COD ID: 7135300

CIF file

Formula: - C27 H20 O5 S -
Comments: Yang, Zhi-Yuan; Li, Xue-Song; Zhang, Ming-Li; You, Zi-Xin; Liang, Yong-Min; Zhou, Ming-Dong Lewis Acid Catalysed Cyclization of Pyridinium 1,4-Zwitterionic Thiolates with Propargyl Alcohols and Fluorescence Applications Chemical Communications (2026)
Space group: P 1 21/c 1
Cell volume: 8996.7
Cell parameters: 14.2771; 37.754; 17.4551; 90; 107.017; 90;

COD ID: 7135301
CIF file	Formula: - C36 H23 F3 I N O - Comments: Jagota, Shivankar; Rana, Samim Sohel; Barman, Chhotan; Choudhury, Joyanta Annulated oxazolium salts as anion-π + interaction-enabled solid-state room-temperature phosphorescent materials Chemical Communications (2026) Space group: P 1 21/n 1 Cell volume: 2959.1 Cell parameters: 6.9559; 28.73; 14.9096; 90; 96.72; 90;

COD ID: 7135302
CIF file	Formula: - C38 H29 I N2 O2 - Comments: Jagota, Shivankar; Rana, Samim Sohel; Barman, Chhotan; Choudhury, Joyanta Annulated oxazolium salts as anion-π + interaction-enabled solid-state room-temperature phosphorescent materials Chemical Communications (2026) Space group: P 1 21 1 Cell volume: 1554.9 Cell parameters: 14.085; 7.2681; 15.308; 90; 97.143; 90;

COD ID: 7135303
CIF file	Formula: - C35 H24 I N O - Comments: Jagota, Shivankar; Rana, Samim Sohel; Barman, Chhotan; Choudhury, Joyanta Annulated oxazolium salts as anion-π + interaction-enabled solid-state room-temperature phosphorescent materials Chemical Communications (2026) Space group: C 1 2/c 1 Cell volume: 6101.2 Cell parameters: 25.9967; 13.28; 17.7015; 90; 93.282; 90;

COD ID: 7135308
CIF file	Formula: - C27 H25 N2 Rb - Comments: Burnett, Stuart; Kennedy, Alan; Mansell, Stephen M.; Weetman, Catherine Ellen Fluorenyl-Tethered N-Heterocyclic Carbene Complexes of the Heavy Alkali Metals Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 4409.06 Cell parameters: 14.3566; 11.8396; 26.4983; 90; 101.79; 90;

COD ID: 7135309
CIF file	Formula: - C46 H69 Cs2 Li N4 Si4 - Comments: Burnett, Stuart; Kennedy, Alan; Mansell, Stephen M.; Weetman, Catherine Ellen Fluorenyl-Tethered N-Heterocyclic Carbene Complexes of the Heavy Alkali Metals Chemical Communications (2026) Space group: P c a 21 Cell volume: 5352.82 Cell parameters: 25.3737; 12.0154; 17.5574; 90; 90; 90;

COD ID: 7135310
CIF file	Formula: - C27 H25 Cs N2 - Comments: Burnett, Stuart; Kennedy, Alan; Mansell, Stephen M.; Weetman, Catherine Ellen Fluorenyl-Tethered N-Heterocyclic Carbene Complexes of the Heavy Alkali Metals Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 4555.59 Cell parameters: 14.4348; 12.0323; 26.6844; 90; 100.598; 90;

COD ID: 7135311
CIF file	Formula: - C44 H28 F18 N6 P2 Ru - Comments: Mandal, Arif Ali; Kumar, Saurav; Singh, Srijan; Mandal, Apurba; Banerjee, Samya; Dhar, Prodyut Novel Ru(II)-Photo-antibiotics for Development of Infection-Resistant Mask Coatings Chemical Communications (2026) Space group: P -1 Cell volume: 2196.74 Cell parameters: 9.0051; 11.4959; 22.2845; 86.46; 80.555; 74.909;

COD ID: 7135312
CIF file	Formula: - C31 H24 Br N2 O4 - Comments: Devi, Manju; Jain, Gyanshree; Gupta, Navya; Ansari, Najmuddin; Singh, Ravi Prakash Atroposelective Synthesis of Barbiturate Substituted Chiral Styrenes Chemical Communications (2026) Space group: P 1 21 1 Cell volume: 1362.6 Cell parameters: 9.214; 14.22; 11.153; 90; 111.181; 90;

COD ID: 7135313
CIF file	Formula: - C4.09 H3.74 N0.17 O0.61 P0.09 - Comments: Devi, Manju; Jain, Gyanshree; Gupta, Navya; Ansari, Najmuddin; Singh, Ravi Prakash Atroposelective Synthesis of Barbiturate Substituted Chiral Styrenes Chemical Communications (2026) Space group: C 1 2 1 Cell volume: 3542.9 Cell parameters: 19.0074; 11.0694; 18.0225; 90; 110.883; 90;

COD ID: 7135314

CIF file

Formula: - C108 H35 Co N5 -
Comments: Wang, Tao; Song, Yupeng; Wang, Chong; Wang, Hongyi; Zhang, Youpeng; Jiang, Ying; Dong, Tianyang; Wu, Bo; Wang, Chun-Ru Fullerene–Porphyrin Nanosheet as an Efficient Catalyst Enables Solar-Light-Driven Ammonia Synthesis Chemical Communications (2026)
Space group: C 1 2/c 1
Cell volume: 13851
Cell parameters: 25.189; 22.7748; 24.3234; 90; 96.945; 90;

COD ID: 7135315

CIF file

Formula: - C16 H10 N4 S -
Comments: Nakamura, Ryo; Sawamura, Yuta; Nakada, Kazushi; Mizoguchi, Ryusuke; Ishii, Ayumi; Yamashita, Tomohiro; Yokota, Hiroko; Richards, Gary James; Hori, Akiko Red-fluorescence under UV and green-SHG under NIR dual-mode emission in yellow crystal of 1,2,5-thiadiazole derivative Chemical Communications (2026)
Space group: C 1 c 1
Cell volume: 1337.2
Cell parameters: 11.947; 17.077; 7.029; 90; 111.18; 90;

COD ID: 7135316

CIF file

Formula: - C40 H28 N6 S -
Comments: Nakamura, Ryo; Sawamura, Yuta; Nakada, Kazushi; Mizoguchi, Ryusuke; Ishii, Ayumi; Yamashita, Tomohiro; Yokota, Hiroko; Richards, Gary James; Hori, Akiko Red-fluorescence under UV and green-SHG under NIR dual-mode emission in yellow crystal of 1,2,5-thiadiazole derivative Chemical Communications (2026)
Space group: P 1 21/c 1
Cell volume: 3150
Cell parameters: 25.61; 7.253; 17.715; 90; 106.797; 90;

COD ID: 7135317
CIF file	Formula: - C33.5 H15 B F15 O Sb - Comments: NGUYEN, THIEN; González-Ortiz, Francisca; Camaret, Ethan; PARK, GYEONGJIN From Oxygen Atom Transfer by Stibine Oxide to Hydroxoantimony Formation via Lewis Acid Capture Chemical Communications (2026) Space group: P 1 21/n 1 Cell volume: 3038.9 Cell parameters: 10.1599; 15.9561; 19.0317; 90; 99.943; 90;

COD ID: 7135318
CIF file	Formula: - C39 H20 B F15 O Sb - Comments: NGUYEN, THIEN; González-Ortiz, Francisca; Camaret, Ethan; PARK, GYEONGJIN From Oxygen Atom Transfer by Stibine Oxide to Hydroxoantimony Formation via Lewis Acid Capture Chemical Communications (2026) Space group: P -1 Cell volume: 3574.3 Cell parameters: 13.4947; 15.3391; 19.1866; 76.297; 81.376; 68.207;

COD ID: 7135319
CIF file	Formula: - C36 H33 B F15 O P - Comments: NGUYEN, THIEN; González-Ortiz, Francisca; Camaret, Ethan; PARK, GYEONGJIN From Oxygen Atom Transfer by Stibine Oxide to Hydroxoantimony Formation via Lewis Acid Capture Chemical Communications (2026) Space group: R 3 :H Cell volume: 2541.2 Cell parameters: 17.232; 17.232; 9.882; 90; 90; 120;

COD ID: 7135320
CIF file	Formula: - C4 H4 Cl2 Fe N2 - Comments: Lassoued, Mohamed Saber; Huang, Xue-Qi; Hussain, Abid; Zheng, Yan-Zhen A Stable Narrow-Bandgap 2D Iron–Pyrazine Framework Exhibiting High Photoconductivity and Spin–Charge Coupling Chemical Communications (2026) Space group: C m m m Cell volume: 309.36 Cell parameters: 12.015; 7.2065; 3.5729; 90; 90; 90;

COD ID: 7135321
CIF file	Formula: - C43 H63 Cl Fe N7 O4 - Comments: Dey Biswas, Doyel; Das, Soumadip; Pal, Debraj; Sen Gupta, Sayam Enantioselective C-H Bond Oxidation using Bio-Inspired Chiral Fe-TAML Catalyst Chemical Communications (2026) Space group: P 1 Cell volume: 2107.14 Cell parameters: 9.0318; 13.1643; 17.9475; 88.547; 81.094; 88.722;

COD ID: 7135322
CIF file	Formula: - C43 H63 Cl Fe N7 O4 - Comments: Dey Biswas, Doyel; Das, Soumadip; Pal, Debraj; Sen Gupta, Sayam Enantioselective C-H Bond Oxidation using Bio-Inspired Chiral Fe-TAML Catalyst Chemical Communications (2026) Space group: P 1 Cell volume: 2109.4 Cell parameters: 9.0356; 13.1688; 17.9549; 88.5; 81.057; 88.78;

COD ID: 7135323

CIF file

Formula: - C19 H14 B F2 N3 O -
Comments: Figliola, Carlotta; Chériaux, Camille; Oppé, Nicolas; Estaque, Lilian; Retailleau, Pascal; Vanthuyne, Nicolas; Pieters, Gregory; Jacquemin, Denis; Ulrich, Gilles Design of Heavy-Atom Free Dipyridomethene Boron Complexes for Singlet Oxygen Emission with Induced Chirality Chemical Communications (2026)
Space group: P 1 21/c 1
Cell volume: 1619.56
Cell parameters: 11.1316; 18.2559; 8.0791; 90; 99.445; 90;

COD ID: 7135324

CIF file

Formula: - C22 H13 B F N3 O -
Comments: Figliola, Carlotta; Chériaux, Camille; Oppé, Nicolas; Estaque, Lilian; Retailleau, Pascal; Vanthuyne, Nicolas; Pieters, Gregory; Jacquemin, Denis; Ulrich, Gilles Design of Heavy-Atom Free Dipyridomethene Boron Complexes for Singlet Oxygen Emission with Induced Chirality Chemical Communications (2026)
Space group: P -1
Cell volume: 836.72
Cell parameters: 7.5432; 8.0975; 14.2914; 95.85; 95.816; 103.652;

COD ID: 7135325

CIF file

Formula: - C28 H22 Fe O2 -
Comments: Parganiha, Devendra; Upadhyay, Yagya Dutt; Khevariya, Sumit; Patil, Pruthviraj Amar; Jaiswal, Svastik; Dhasmana, Yogesh; Kumar, Sangit Native Carboxylate-Assisted Enantioselective C-H Annulations with Allenes and 1,3-Dienes on Ferrocene Chemical Communications (2026)
Space group: P 21 21 21
Cell volume: 2053.9
Cell parameters: 8.2412; 11.3911; 21.879; 90; 90; 90;

COD ID: 7135326
CIF file	Formula: - C24 H14 F3 N - Comments: Wang, Zhengcheng; Gao, Lin; Yu, Qi; Wang, Guo-Ming Substituent-modulated organic single crystals with rapid natural light photomechanical response Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 1803.49 Cell parameters: 4.6753; 36.904; 10.6315; 90; 100.522; 90;

COD ID: 7135327
CIF file	Formula: - C23 H13 F2 N - Comments: Wang, Zhengcheng; Gao, Lin; Yu, Qi; Wang, Guo-Ming Substituent-modulated organic single crystals with rapid natural light photomechanical response Chemical Communications (2026) Space group: C 1 2/c 1 Cell volume: 3324.32 Cell parameters: 17.2254; 7.4849; 26.994; 90; 107.221; 90;

COD ID: 7135328
CIF file	Formula: - C23 H15 N - Comments: Wang, Zhengcheng; Gao, Lin; Yu, Qi; Wang, Guo-Ming Substituent-modulated organic single crystals with rapid natural light photomechanical response Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 1587.4 Cell parameters: 18.3518; 5.289; 17.3164; 90; 109.188; 90;

COD ID: 7135329
CIF file	Formula: - C108 H155 Cs2 O12 P7 Pd6 - Comments: Krämer, Felix; Kennedy, Alan; Fernandez, Israel; Mulvey, Robert E. A Palladium Inverse Crown: Synthesis and Characterisation Chemical Communications (2026) Space group: P n a 21 Cell volume: 11780.8 Cell parameters: 30.981; 14.8646; 25.5815; 90; 90; 90;

COD ID: 7135330
CIF file	Formula: - C15 H8 O2 S2 - Comments: Ueda, Masafumi; Uehara, Asuka; Usui, Kazuteru; Hasegawa, Masashi A Folded Mechanochromic Organic Fluorophore Based on Thianthrene-Fused Coumarin Chemical Communications (2026) Space group: I 1 2/a 1 Cell volume: 2413.02 Cell parameters: 13.5461; 3.8602; 46.3601; 90; 95.505; 90;

COD ID: 7135331
CIF file	Formula: - C15 H8 O2 S2 - Comments: Ueda, Masafumi; Uehara, Asuka; Usui, Kazuteru; Hasegawa, Masashi A Folded Mechanochromic Organic Fluorophore Based on Thianthrene-Fused Coumarin Chemical Communications (2026) Space group: P 1 21/n 1 Cell volume: 1191.48 Cell parameters: 6.8001; 14.5918; 12.0415; 90; 94.287; 90;

COD ID: 7135332
CIF file	Formula: - C32 H47 Au B21 P - Comments: Thornton, Ragene; French, Kirk; Shuford, Kevin; Martin, Caleb Daniel Reactivity of Gold and Copper Acetylide with a Secondary Borane Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 4037.8 Cell parameters: 15.4148; 16.6168; 15.9182; 90; 97.988; 90;

COD ID: 7135333
CIF file	Formula: - C32 H47 B21 Cu P - Comments: Thornton, Ragene; French, Kirk; Shuford, Kevin; Martin, Caleb Daniel Reactivity of Gold and Copper Acetylide with a Secondary Borane Chemical Communications (2026) Space group: P 1 21/c 1 Cell volume: 4039.9 Cell parameters: 12.6977; 13.7024; 23.9248; 90; 103.948; 90;

COD ID: 7135334
CIF file	Formula: - C42 H25 N3 S - Comments: Liu, Minglun; Zheng, Xiaoxue; Zhang, Min; Yao, Shankun; Zhang, Pan; Liang, Lili; Chen, Yuncong Construction of a pyrene based AIEgen for ratiometric detection of trace water in organic solvents Chemical Communications (2026) Space group: P 1 c 1 Cell volume: 3021.7 Cell parameters: 21.659; 19.2095; 7.3318; 90; 97.873; 90;

COD ID: 7135335

CIF file

Formula: - C24 H23 N3 O3 S -
Comments: Hu, Chunyang; Liu, Zuquan; Li, Chenxing; Feng, Jianquan; Zhu, Yiwei; Du, Ding Enantioselective Synthesis of N-Arylpyrrole Aldehydes via NHC-Organocatalytic Atroposelective Desymmetrization Followed by Kinetic Resolution Chemical Communications (2026)
Space group: P b c n
Cell volume: 4374.7
Cell parameters: 35.6279; 7.9727; 15.4012; 90; 90; 90;

COD ID: 7160912
CIF file	Formula: - C24 H17 N O4 - Comments: Ahmad, Farukh; Singh, Rajeev; Ahmed, Naseem Solvent-assisted one-pot green and diastereoselective synthesis of 1,4-oxazines and 1,4-thioxazines under metal-free conditions Organic & Biomolecular Chemistry (2026) Space group: P 1 21/c 1 Cell volume: 1787.1 Cell parameters: 20.836; 7.1335; 21.837; 90; 146.592; 90;

COD ID: 7251393
CIF file	Formula: - C8 H19 N O8 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P 1 21/c 1 Cell volume: 1226.91 Cell parameters: 17.7514; 5.68736; 13.0019; 90; 110.823; 90;

COD ID: 7251394

CIF file

Formula: - C15 H15 Cl N2 O7 -
Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026)
Space group: P -1
Cell volume: 803.26
Cell parameters: 8.3098; 9.6361; 10.8666; 96.5031; 106.955; 101.119;

COD ID: 7251395
CIF file	Formula: - C11 H17 N3 O6 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P -1 Cell volume: 1325.6 Cell parameters: 5.5781; 9.1736; 25.93; 91.052; 92.193; 90.552;

COD ID: 7251396
CIF file	Formula: - C15 H14 N2 O5 S - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P c a 21 Cell volume: 2904 Cell parameters: 14.34; 13.802; 14.671; 90; 90; 90;

COD ID: 7251397

CIF file

Formula: - C20 H26 N2 O11 -
Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026)
Space group: P 1 21/c 1
Cell volume: 2138.09
Cell parameters: 12.3917; 11.7324; 14.9593; 90; 100.549; 90;

COD ID: 7251398
CIF file	Formula: - C9 H10 N O4 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P -1 Cell volume: 463.1 Cell parameters: 6.6096; 7.0278; 11.2902; 72.9234; 74.834; 69.87;

COD ID: 7251399

CIF file

Formula: - C20 H38 N2 O16 -
Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026)
Space group: P -1
Cell volume: 1276.85
Cell parameters: 8.6376; 9.5114; 15.9873; 79.9178; 80.8899; 88.4671;

COD ID: 7251400
CIF file	Formula: - C16 H36 N2 O15 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: C 1 2/c 1 Cell volume: 2417.2 Cell parameters: 30.203; 5.6916; 14.254; 90; 99.433; 90;

COD ID: 7251401
CIF file	Formula: - C8 H9 N O2 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P n a 21 Cell volume: 744.13 Cell parameters: 13.6402; 8.6125; 6.3343; 90; 90; 90;

COD ID: 7251402
CIF file	Formula: - C13 H13 N3 O6 - Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026) Space group: P -1 Cell volume: 662.79 Cell parameters: 5.8889; 10.2677; 11.2466; 102.25; 93.673; 91.141;

COD ID: 7251403

CIF file

Formula: - C36 H60.19 N3 O16.6 -
Comments: Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms CrystEngComm (2026)
Space group: P -1
Cell volume: 1988.5
Cell parameters: 7.5263; 12.781; 21.505; 77.876; 88.418; 79.491;

COD ID: 7251404
CIF file	Formula: - C24 H12 Br4 N2 - Comments: Li, Linjie; Shang, Yunyi; Gao, Yujia; Zhang, Yanfeng; Xu, Chao; Zhang, Qichun; Wang, Hui Metal-free and visible photons for the dehydrogenative N-N coupling of amines: Powerful methods to optoelectronic materials Green Chemistry (2026) Space group: P b c a Cell volume: 4404.2 Cell parameters: 10.524; 15.0537; 27.8; 90; 90; 90;

COD ID: 7251405

CIF file

Formula: - C70 H64 N8 O8 -
Comments: Tharmalingam, Balamurugan; Sukhanov, Andrey A.; Pei, Yuying; Sambucari, Greta; Ramos, Talita; Zhao, Jianzhang; Voronkova, Violeta K.; Di Donato, Mariangela Long-lived charge separated states in spiro-compact rhodamine–naphthalenediimide D–A–D systems: synthesis and time-resolved optical and electron paramagnetic resonance spectroscopic studies Physical Chemistry Chemical Physics (2026)
Space group: P 1 21/n 1
Cell volume: 3183.8
Cell parameters: 15.695; 11.5619; 18.283; 90; 106.336; 90;

COD ID: 7251406

CIF file

Formula: - C76 H74 N9 O8 -
Comments: Tharmalingam, Balamurugan; Sukhanov, Andrey A.; Pei, Yuying; Sambucari, Greta; Ramos, Talita; Zhao, Jianzhang; Voronkova, Violeta K.; Di Donato, Mariangela Long-lived charge separated states in spiro-compact rhodamine–naphthalenediimide D–A–D systems: synthesis and time-resolved optical and electron paramagnetic resonance spectroscopic studies Physical Chemistry Chemical Physics (2026)
Space group: P -1
Cell volume: 3347.5
Cell parameters: 12.294; 13.387; 20.532; 86.872; 87.845; 83.021;

COD ID: 7251411
CIF file	Formula: - C21 H20 O4 - Comments: Ahamed , Riyaaz; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit Dual-Responsive Benzylidene Indanone Crystals: Mechanical Flexibility Coupled with Reversible Acidochromism CrystEngComm (2026) Space group: P 1 21/c 1 Cell volume: 1732.1 Cell parameters: 4.6803; 40.269; 9.2487; 90; 96.433; 90;

COD ID: 7251412
CIF file	Formula: - C19 H17 O4 - Comments: Ahamed , Riyaaz; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit Dual-Responsive Benzylidene Indanone Crystals: Mechanical Flexibility Coupled with Reversible Acidochromism CrystEngComm (2026) Space group: P 1 21/c 1 Cell volume: 1546.7 Cell parameters: 4.8459; 35.354; 9.1074; 90; 97.576; 90;

COD ID: 7251433

CIF file

Formula: - C29 H20 Cl2 Cu2 N2 O7 -
Comments: Pantelis, Konstantinos; Alexandropoulos, Dimitris I.; Escuer, Albert; Kostakis, George E.; Stamatatos, Theocharis C. A Preformed 1‐D {CuII2}n Helical Chain as Precursor to a Decanuclear 0-D {CuII8MnII2} Cluster: Synthesis, Structure and Magnetism CrystEngComm (2026)
Space group: P 21 21 21
Cell volume: 2622.57
Cell parameters: 12.8851; 13.6763; 14.8823; 90; 90; 90;

COD ID: 7251434

CIF file

Formula: - C369 H266 Cl24 Cu24 Mn6 N40.5 O90.25 -
Comments: Pantelis, Konstantinos; Alexandropoulos, Dimitris I.; Escuer, Albert; Kostakis, George E.; Stamatatos, Theocharis C. A Preformed 1‐D {CuII2}n Helical Chain as Precursor to a Decanuclear 0-D {CuII8MnII2} Cluster: Synthesis, Structure and Magnetism CrystEngComm (2026)
Space group: C 1 2/c 1
Cell volume: 36915.4
Cell parameters: 77.1822; 16.6415; 29.2589; 90; 100.799; 90;

COD ID: 7719964

CIF file

Formula: - C20 H14 B F6 N4 Tl -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P n m a
Cell volume: 2025.73
Cell parameters: 11.9158; 10.0878; 16.8524; 90; 90; 90;

COD ID: 7719965

CIF file

Formula: - C30 H19 B F9 N6 Tl -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P 1 21/n 1
Cell volume: 2965.7
Cell parameters: 9.5841; 22.8479; 13.5563; 90; 92.504; 90;

COD ID: 7719966

CIF file

Formula: - C18 H14 B F10 N4 S2 Tl -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P -1
Cell volume: 2302.17
Cell parameters: 11.4445; 14.4529; 15.6856; 88.495; 74.164; 67.788;

COD ID: 7719967

CIF file

Formula: - C20.5 H19 Ag B Cl F10 N4 S2 -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P 1 21/c 1
Cell volume: 5359.2
Cell parameters: 20.1677; 19.4767; 13.7339; 90; 96.574; 90;

COD ID: 7719968

CIF file

Formula: - C24 H16 B F6 N2 Tl -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P -1
Cell volume: 1108
Cell parameters: 10.178; 10.282; 10.926; 87.878; 77.995; 82.193;

COD ID: 7719969

CIF file

Formula: - C22 H18 Ag B F6 N4 -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P -1
Cell volume: 3384.3
Cell parameters: 12.2646; 17.0628; 17.8516; 65.253; 87.773; 86.014;

COD ID: 7719970

CIF file

Formula: - C27 H22 Ag B Cl2 F6 N2 -
Comments: Noonikara Poyil, Anurag; Phan, Vo Quang Huy; Vanga, Mukundam; Boretskyi, Andrii; Mykhailiuk, Pavel K.; Dias, Rasika Fluorinated B-phenylated scorpionates as tunable platforms for stabilizing thallium(I) and silver(I)-ethylene complexes Dalton Transactions (2026)
Space group: P 1 21/c 1
Cell volume: 2603
Cell parameters: 15.9889; 16.2352; 10.0306; 90; 91.382; 90;

COD ID: 7719972
CIF file	Formula: - C36.5 H30.5 As Cl1.5 O3 P Pd - Comments: Tonon, Giovanni; Rafaniello, Anna; Mauceri, Matteo; Demitri, Nicola; Scattolin, Thomas; Rizzolio, Flavio; Visentin, Fabiano Palladium(0) and Juglone: a New Alliance in the Fight Against Ovarian Cancer Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 6405 Cell parameters: 38.767; 9.041; 18.57; 90; 100.26; 90;

COD ID: 7719973
CIF file	Formula: - C33 H30 N O3 P Pd - Comments: Tonon, Giovanni; Rafaniello, Anna; Mauceri, Matteo; Demitri, Nicola; Scattolin, Thomas; Rizzolio, Flavio; Visentin, Fabiano Palladium(0) and Juglone: a New Alliance in the Fight Against Ovarian Cancer Dalton Transactions (2026) Space group: P b c a Cell volume: 11620 Cell parameters: 22.85; 18.79; 27.065; 90; 90; 90;

COD ID: 7719974
CIF file	Formula: - C48 H36 Cl6 O4 P2 Pd - Comments: Tonon, Giovanni; Rafaniello, Anna; Mauceri, Matteo; Demitri, Nicola; Scattolin, Thomas; Rizzolio, Flavio; Visentin, Fabiano Palladium(0) and Juglone: a New Alliance in the Fight Against Ovarian Cancer Dalton Transactions (2026) Space group: P -1 Cell volume: 2219.6 Cell parameters: 11.024; 12.556; 16.672; 84.3; 80.22; 78.01;

COD ID: 7719975
CIF file	Formula: - C33 H30 N O3 P Pd - Comments: Tonon, Giovanni; Rafaniello, Anna; Mauceri, Matteo; Demitri, Nicola; Scattolin, Thomas; Rizzolio, Flavio; Visentin, Fabiano Palladium(0) and Juglone: a New Alliance in the Fight Against Ovarian Cancer Dalton Transactions (2026) Space group: P b c a Cell volume: 11227 Cell parameters: 22.714; 18.484; 26.741; 90; 90; 90;

COD ID: 7719976
CIF file	Formula: - C47 H59 Cl2 F6 Ir O P2 - Comments: Talavera, Maria; Gómez, Antonio; Otero, Nicolás; Peña-Gallego, Ángeles; Bolaño, Sandra Unprecedented 1,2-mesityl shift for the synthesis of iridafurans Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 4573 Cell parameters: 14.0383; 19.3462; 18.1476; 90; 111.899; 90;

COD ID: 7719977

CIF file

Formula: - C30 H30.8 Cl2 Cu N8 O8.4 -
Comments: Kumawat, Manoj Kumar; Mathur, Shobhit; Rathnam, Sharan Shanmuga Vuppaladadium; Jangra, Jitender; Roy, Anindya; Maji, Somnath Comprehensive Design, Synthesis of Methyl Substituted Benzimidazole-based Mononuclear Copper(II) Complexes and Evaluation of DNA Cleavage and ROS-induced Apoptosis Dalton Transactions (2026)
Space group: P -1
Cell volume: 1705.5
Cell parameters: 12.3764; 12.7856; 13.4518; 95.205; 115.84; 111.233;

COD ID: 7719978

CIF file

Formula: - C34 H33 Cl2 Cu N9 O8 -
Comments: Kumawat, Manoj Kumar; Mathur, Shobhit; Rathnam, Sharan Shanmuga Vuppaladadium; Jangra, Jitender; Roy, Anindya; Maji, Somnath Comprehensive Design, Synthesis of Methyl Substituted Benzimidazole-based Mononuclear Copper(II) Complexes and Evaluation of DNA Cleavage and ROS-induced Apoptosis Dalton Transactions (2026)
Space group: P n m a
Cell volume: 3760.9
Cell parameters: 10.7413; 11.326; 30.914; 90; 90; 90;

COD ID: 7719979

CIF file

Formula: - C32 H27 Cl2 Cu N9 O8 -
Comments: Kumawat, Manoj Kumar; Mathur, Shobhit; Rathnam, Sharan Shanmuga Vuppaladadium; Jangra, Jitender; Roy, Anindya; Maji, Somnath Comprehensive Design, Synthesis of Methyl Substituted Benzimidazole-based Mononuclear Copper(II) Complexes and Evaluation of DNA Cleavage and ROS-induced Apoptosis Dalton Transactions (2026)
Space group: P -1
Cell volume: 1673.6
Cell parameters: 10.3672; 11.7373; 13.862; 83.732; 88.201; 86.873;

COD ID: 7719980

CIF file

Formula: - C32 H31 Cl2 Cu N7 O8 -
Comments: Kumawat, Manoj Kumar; Mathur, Shobhit; Rathnam, Sharan Shanmuga Vuppaladadium; Jangra, Jitender; Roy, Anindya; Maji, Somnath Comprehensive Design, Synthesis of Methyl Substituted Benzimidazole-based Mononuclear Copper(II) Complexes and Evaluation of DNA Cleavage and ROS-induced Apoptosis Dalton Transactions (2026)
Space group: P 1 21 1
Cell volume: 1720.4
Cell parameters: 8.2663; 20.2627; 10.2878; 90; 93.252; 90;

COD ID: 7719981

CIF file

Formula: - C72 H64 Cu8.5 N24 Na O50 P W11.5 -
Comments: Wang, Quan Quan; Ren, Rong-Xian; Gong, Rui Jie; Zhao, Shao Da; Yan, Pinfang; Xu, Yan Polyoxometalate-based Catalysts for Visible-Light Driven Hydrolytic Hydrogen Production: Coordinatively Unsaturated Cu-based Active Sites Enhance Performance Dalton Transactions (2026)
Space group: C 1 2/c 1
Cell volume: 10170.8
Cell parameters: 28.447; 12.6282; 28.313; 90; 90.361; 90;

COD ID: 7719982

CIF file

Formula: - C144 H162 Cu13 N54 O66 Si W11 -
Comments: Wang, Quan Quan; Ren, Rong-Xian; Gong, Rui Jie; Zhao, Shao Da; Yan, Pinfang; Xu, Yan Polyoxometalate-based Catalysts for Visible-Light Driven Hydrolytic Hydrogen Production: Coordinatively Unsaturated Cu-based Active Sites Enhance Performance Dalton Transactions (2026)
Space group: R -3 :H
Cell volume: 13747
Cell parameters: 28.347; 28.347; 19.755; 90; 90; 120;

COD ID: 7719983

CIF file

Formula: - C55 H66 N2 O2 Sb -
Comments: Baryshnikova, Svetlana V.; Shisterova, Polina; Arsenyev, Maxim V.; Meshcheryakova, Irina N.; Kolevatov, Dmitry S.; Yakushev, Ilya; Aysin, Rinat R.; Kocherova, Tatyana N.; Piskunov, Alexandr Vladimirovich Antimony(V) complexes with a tetradentate ONNO redox-active ligands. Optical, electrochemical and photothermal properties Dalton Transactions (2026)
Space group: P -4 21 c
Cell volume: 9487
Cell parameters: 22.677; 22.677; 18.449; 90; 90; 90;

COD ID: 7719984

CIF file

Formula: - C65.5 H77 N2 O2 Sb -
Comments: Baryshnikova, Svetlana V.; Shisterova, Polina; Arsenyev, Maxim V.; Meshcheryakova, Irina N.; Kolevatov, Dmitry S.; Yakushev, Ilya; Aysin, Rinat R.; Kocherova, Tatyana N.; Piskunov, Alexandr Vladimirovich Antimony(V) complexes with a tetradentate ONNO redox-active ligands. Optical, electrochemical and photothermal properties Dalton Transactions (2026)
Space group: P 1 21/c 1
Cell volume: 5490
Cell parameters: 10.3867; 28.242; 18.778; 90; 94.676; 90;

COD ID: 7719985
CIF file	Formula: - C57 H52 Mn2 N12 O S4 - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: P 1 Cell volume: 1331.24 Cell parameters: 8.5398; 10.3318; 15.7479; 86.416; 82.774; 75.071;

COD ID: 7719986
CIF file	Formula: - C105 H100 I8 Mn4 N16 O - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: C 1 2 1 Cell volume: 5136.4 Cell parameters: 18.502; 9.0264; 30.8068; 90; 93.298; 90;

COD ID: 7719987
CIF file	Formula: - C55 H60 Cl4 Mn2 N8 O3 - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: P 1 21 1 Cell volume: 2557.2 Cell parameters: 16.7866; 8.6559; 17.8003; 90; 98.624; 90;

COD ID: 7719988
CIF file	Formula: - C14 H17 Br2 Mn N3 - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: P -1 Cell volume: 775.48 Cell parameters: 7.4816; 8.1505; 13.3712; 73.602; 85.395; 83.015;

COD ID: 7719989
CIF file	Formula: - C14 H17 Cl2 Mn N3 - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: P -1 Cell volume: 748.28 Cell parameters: 7.4659; 7.887; 13.229; 76.203; 82.975; 83.785;

COD ID: 7719990
CIF file	Formula: - C14 H17 Mn N9 - Comments: Pilichos, Evangelos; Mayans, Julia; Escuer, Albert Probing the need of a very low axial zero field splitting in MnII systems with slow relaxation of the magnetization Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 1633.3 Cell parameters: 15.5045; 8.2247; 12.8592; 90; 95.122; 90;

COD ID: 7719991
CIF file	Formula: - C72 H144 N8 Na4 O24 P14 Pd2 - Comments: Pan, Fuxing; Tang, Yu; Deng, Minghao; Wang, Xinyue [Pd2(η4-P7)2]4–: a Pd2 dimer sandwiched by two anionic nortricyclane-type polyphosphide Dalton Transactions (2026) Space group: P -1 Cell volume: 2463.02 Cell parameters: 13.1373; 13.3017; 16.1154; 105.89; 91.806; 112.976;

COD ID: 7719993

CIF file

Formula: - C8 H7 N O9 Pr -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 527.22
Cell parameters: 7.438; 8.6512; 8.7348; 72.143; 80.254; 87.762;

COD ID: 7719994

CIF file

Formula: - C14 H9 Dy N2 O11 -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 738.01
Cell parameters: 6.1592; 8.7809; 14.7102; 76.981; 81.424; 72.924;

COD ID: 7719995

CIF file

Formula: - C14 H9 Eu N2 O11 -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 744.33
Cell parameters: 6.1792; 8.794; 14.8202; 76.894; 81.634; 72.212;

COD ID: 7719996

CIF file

Formula: - C8 H7 N Nd O9 -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 523.47
Cell parameters: 7.4577; 8.6194; 8.6832; 72.126; 80.223; 87.674;

COD ID: 7719997

CIF file

Formula: - C14 H9 Er N2 O11 -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 733.35
Cell parameters: 6.1436; 8.7628; 14.6574; 77.041; 81.399; 73.263;

COD ID: 7719998

CIF file

Formula: - C14 H9 Gd N2 O11 -
Comments: Katuwana Arachchige, Ashanthi Kumari; Lottes, Brett; Unruh, Daniel K.; Greer, Samuel M.; Stein, Benjamin William; Carter, Korey Prescott Combining Coordination and Chelation Moieties to Engineer a New Linker for Lanthanide Coordination Chemistry Dalton Transactions (2026)
Space group: P -1
Cell volume: 742.55
Cell parameters: 6.1766; 8.7797; 14.8046; 76.912; 81.497; 72.376;

COD ID: 7719999

CIF file

Formula: - C20 H29 Br3 Ru2 -
Comments: Tay, Boon Ying; Wang, Cun; Tan, Davin; Dighe, Shashikant U.; Stubbs, Ludger P.; Gholap, Sandeep Suryabhan; Huynh, Han Vinh Dinuclear p-Cymene Ruthenium Hydrido Complexes as Active Catalysts for the Hydrogenation of Levulinic Acid to γ-Valerolactone with Formic Acid as the Hydrogen Source Dalton Transactions (2026)
Space group: P b c a
Cell volume: 4392.9
Cell parameters: 13.961; 16.166; 19.464; 90; 90; 90;

COD ID: 7720000
CIF file	Formula: - C25 H29 Br2 N5 Ni - Comments: Mondal, Bijan; Mohanty, Aisa; Daw, Prosenjit Dehydrogenation of Ammonia-Borane Employing an Air-stable, Phosphine-free Molecular Nickel Pincer Catalyst Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 2372.67 Cell parameters: 9.0447; 28.1677; 9.3132; 90; 90.348; 90;

COD ID: 7720001
CIF file	Formula: - C16 H15 Cl2 N3 Ni O - Comments: Mondal, Bijan; Mohanty, Aisa; Daw, Prosenjit Dehydrogenation of Ammonia-Borane Employing an Air-stable, Phosphine-free Molecular Nickel Pincer Catalyst Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 1629.54 Cell parameters: 9.31157; 6.89229; 25.41149; 90; 92.3034; 90;

COD ID: 7720002
CIF file	Formula: - C11.5 H12.5 Cl N2.5 Ni0.5 - Comments: Mondal, Bijan; Mohanty, Aisa; Daw, Prosenjit Dehydrogenation of Ammonia-Borane Employing an Air-stable, Phosphine-free Molecular Nickel Pincer Catalyst Dalton Transactions (2026) Space group: C 1 2/c 1 Cell volume: 2109.05 Cell parameters: 11.1625; 12.3317; 15.6518; 90; 101.791; 90;

COD ID: 7720003
CIF file	Formula: - C38 H118 Cu N6 O26 P4 - Comments: Chaudhary, Savi; Murugavel, Ramaswamy Ligand-Mediated Modulation in Copper(II) Complexes for Four-Electron Oxygen Reduction in Neutral Medium Dalton Transactions (2026) Space group: P -1 Cell volume: 1695.7 Cell parameters: 10.347; 11.574; 16.044; 91.49; 107.483; 110.675;

COD ID: 7720004
CIF file	Formula: - C22 H54 Cu N2 O9 P2 - Comments: Chaudhary, Savi; Murugavel, Ramaswamy Ligand-Mediated Modulation in Copper(II) Complexes for Four-Electron Oxygen Reduction in Neutral Medium Dalton Transactions (2026) Space group: P 21 21 21 Cell volume: 6816.9 Cell parameters: 8.8691; 24.7007; 31.117; 90; 90; 90;

COD ID: 7720005

CIF file

Formula: - C28 H26 Cl3 F3 O3 P2 Pd S -
Comments: Blom, Burgert; Prince, Sharon; Roufosse, Basile; Brice, Thomas; Papaldo, Marco; Macharia, Lucy; Serala, Karabo; Mlaza, Vuyo; Medupe, Thato; Marschner, Christoph; Cleij, Thomas Mono- and Bimetallic Homo- and Heterodinuclear Pd and Pt Complexes Bridged by Diphosphines: Synthesis, Characterisation and Cytotoxicity Dalton Transactions (2026)
Space group: P -1
Cell volume: 1532.45
Cell parameters: 10.12541; 13.0254; 13.97395; 117.407; 104.604; 95.7305;

COD ID: 7720006

CIF file

Formula: - C41.8 H39.6 Cl2.53 F3.06 O2.86 P3 Pd S0.95 -
Comments: Blom, Burgert; Prince, Sharon; Roufosse, Basile; Brice, Thomas; Papaldo, Marco; Macharia, Lucy; Serala, Karabo; Mlaza, Vuyo; Medupe, Thato; Marschner, Christoph; Cleij, Thomas Mono- and Bimetallic Homo- and Heterodinuclear Pd and Pt Complexes Bridged by Diphosphines: Synthesis, Characterisation and Cytotoxicity Dalton Transactions (2026)
Space group: P 1 21/c 1
Cell volume: 4147.49
Cell parameters: 14.0876; 15.3403; 19.8791; 90; 105.111; 90;

COD ID: 7720007

CIF file

Formula: - C65 H66 Cl3 F3 O3 P4 Pd Ru S -
Comments: Blom, Burgert; Prince, Sharon; Roufosse, Basile; Brice, Thomas; Papaldo, Marco; Macharia, Lucy; Serala, Karabo; Mlaza, Vuyo; Medupe, Thato; Marschner, Christoph; Cleij, Thomas Mono- and Bimetallic Homo- and Heterodinuclear Pd and Pt Complexes Bridged by Diphosphines: Synthesis, Characterisation and Cytotoxicity Dalton Transactions (2026)
Space group: P 1 21/n 1
Cell volume: 6311.98
Cell parameters: 10.2907; 17.9374; 34.5299; 90; 97.988; 90;

COD ID: 7720008
CIF file	Formula: - C35 H38 Fe N5 O4 Se - Comments: Dey, Bijoy; Titis, Jan; Mehta, Sakshi; Mondal, Abhishake; Chandrasekhar, Vadapalli Thermal Monomerization Unlocks 3/2↔5/2 Spin Crossover in a Kinetically Trapped High Spin Fe(III) Dimer Dalton Transactions (2026) Space group: P 1 21/c 1 Cell volume: 3384.4 Cell parameters: 10.5373; 10.8063; 29.723; 90; 90.486; 90;

COD ID: 7720009
CIF file	Formula: - C39 H48 Fe2 N6 O7 Se2 - Comments: Dey, Bijoy; Titis, Jan; Mehta, Sakshi; Mondal, Abhishake; Chandrasekhar, Vadapalli Thermal Monomerization Unlocks 3/2↔5/2 Spin Crossover in a Kinetically Trapped High Spin Fe(III) Dimer Dalton Transactions (2026) Space group: P -1 Cell volume: 2077.1 Cell parameters: 11.0509; 11.3802; 19.4658; 73.82; 74.571; 63.611;

COD ID: 7720010

CIF file

Formula: - C18 H21 F6 Mn N3 O4 P -
Comments: Paul, Bhaswati; Dabare, Kusalvin; Bocarsly, Joshua D.; Mills, L. Reginald Crystallographic Evidence of a Trinuclear (salen)Manganese(IV/III/IV)-μ-Oxo Formed during Catalytic C(sp3)–H Oxidation Reactions Dalton Transactions (2026)
Space group: P -1
Cell volume: 1103.62
Cell parameters: 6.9874; 12.2254; 13.3032; 102.936; 94.353; 91.086;

COD ID: 7720011
CIF file	Formula: - C84 H118 Cl Mn2 N4 O9 - Comments: Paul, Bhaswati; Dabare, Kusalvin; Bocarsly, Joshua D.; Mills, L. Reginald Crystallographic Evidence of a Trinuclear (salen)Manganese(IV/III/IV)-μ-Oxo Formed during Catalytic C(sp3)–H Oxidation Reactions Dalton Transactions (2026) Space group: C 2 2 21 Cell volume: 8231.14 Cell parameters: 18.8329; 30.9457; 14.1235; 90; 90; 90;

COD ID: 7720012

CIF file

Formula: - C45 H60 F5 Mn N2 O5 -
Comments: Paul, Bhaswati; Dabare, Kusalvin; Bocarsly, Joshua D.; Mills, L. Reginald Crystallographic Evidence of a Trinuclear (salen)Manganese(IV/III/IV)-μ-Oxo Formed during Catalytic C(sp3)–H Oxidation Reactions Dalton Transactions (2026)
Space group: P -1
Cell volume: 2277.01
Cell parameters: 11.7342; 14.6513; 15.2022; 64.452; 75.527; 87.51;

COD ID: 7720013

CIF file

Formula: - C78 H102.5 F6 Mn2 N7.5 O5.5 P -
Comments: Paul, Bhaswati; Dabare, Kusalvin; Bocarsly, Joshua D.; Mills, L. Reginald Crystallographic Evidence of a Trinuclear (salen)Manganese(IV/III/IV)-μ-Oxo Formed during Catalytic C(sp3)–H Oxidation Reactions Dalton Transactions (2026)
Space group: P -1
Cell volume: 7775.8
Cell parameters: 17.5632; 21.6143; 23.7547; 105.262; 95.103; 113.618;

COD ID: 7720014

CIF file

Formula: - C122 H161.5 F6 Mn3 N7.5 O11 P -
Comments: Paul, Bhaswati; Dabare, Kusalvin; Bocarsly, Joshua D.; Mills, L. Reginald Crystallographic Evidence of a Trinuclear (salen)Manganese(IV/III/IV)-μ-Oxo Formed during Catalytic C(sp3)–H Oxidation Reactions Dalton Transactions (2026)
Space group: P -1
Cell volume: 5991.32
Cell parameters: 13.8836; 19.2316; 23.6564; 102.862; 98.722; 97.824;

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