Search results

Formula: - Ba2 Mn1.71 Te5 Y0.87 -
Comments: Yadav, Sweta; Prakash, Jai Synthesis and crystal structure of Ba2Y0.87(1)Mn1.71(1)Te5 Acta Crystallographica Section C Structural Chemistry 80(1) (2024)
Space group: C 1 2/m 1
Cell volume: 655.56
Cell parameters: 15.1466; 4.5782; 10.606; 90; 116.956; 90;

COD ID: 2022997

Formula: - C15 H17 Br N2 S -
Comments: Savin, J. Alejandro; Ávila-Ortíz, C. Gabriela; Leyva-Ramírez, Marco Antonio; Juaristi, Eusebio X-ray crystallographic structure of a novel enantiopure chiral isothiourea with potential applications in enantioselective synthesis Acta Crystallographica Section C Structural Chemistry 80(1) (2024) 15-20
Space group: P 21 21 21
Cell volume: 1422.14
Cell parameters: 7.9846; 9.1982; 19.3636; 90; 90; 90;

COD ID: 2023017

Formula: - C66 H44 Cu3 Eu2 N18 O31 -
Comments: Yang, Ke; Yang, Yuting; Yao, Ziqin; Cheng, Sisi; Cui, Xue; Wang, Xingyi; Han, Yi; Yi, Feiyan; Mo, Guang High-pressure study of a 3d–4f heterometallic CuEu–organic skeleton Acta Crystallographica Section C Structural Chemistry 80(2) (2024) 49-55
Space group: R -3 c :H
Cell volume: 10785.7
Cell parameters: 14.0021; 14.0021; 63.523; 90; 90; 120;

COD ID: 2023076

Formula: - C18 H19 Br N2 O3 S -
Comments: Kolade, Sherif O.; Aina, Oluwafemi S.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. Synthesis, crystal structure and in-silico evaluation of arylsulfonamide Schiff bases for potential activity against colon cancer. Acta crystallographica. Section C, Structural chemistry 80(Pt 4) (2024) 129-142
Space group: P b c a
Cell volume: 3789.3
Cell parameters: 12.407; 17.425; 17.5276; 90; 90; 90;

COD ID: 2023209

Formula: - C17 H18 N6 -
Comments: Peng, Ziyu; Ye, Long Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate Acta Crystallographica Section C Structural Chemistry 80(8) (2024)
Space group: P 1 21 1
Cell volume: 3230.53
Cell parameters: 8.711; 19.5857; 18.9372; 90; 90.857; 90;

COD ID: 2023210

Formula: - C17 H22 N6 O2 -
Comments: Peng, Ziyu; Ye, Long Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate Acta Crystallographica Section C Structural Chemistry 80(8) (2024)
Space group: P 21 21 21
Cell volume: 3569.4
Cell parameters: 9.9563; 15.1596; 23.6491; 90; 90; 90;

COD ID: 2023211

Formula: - C17 H21 N6 O4 P -
Comments: Peng, Ziyu; Ye, Long Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate Acta Crystallographica Section C Structural Chemistry 80(8) (2024)
Space group: P 21 21 21
Cell volume: 3782.2
Cell parameters: 7.1398; 12.0894; 43.818; 90; 90; 90;

COD ID: 2023274

Formula: - C11 H10 N4 O5 -
Comments: Książkiewicz, Olga A salt from biologically active compounds pyridine-2,3-dicarboxylic (quinolinic) acid and cytosine. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 742-747
Space group: P 1 21/n 1
Cell volume: 1102.76
Cell parameters: 3.6374; 11.3412; 26.751; 90; 92.162; 90;

COD ID: 2312365

Formula: - C14 H14 N2 O6 U -
Comments: Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry 80(1) (2024)
Space group: P 1 21/n 1
Cell volume: 1551.9
Cell parameters: 7.734; 19.01; 10.6154; 90; 96.106; 90;

COD ID: 2312366

Formula: - C34 H36 N6 O15 U3 -
Comments: Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry 80(1) (2024)
Space group: P 1 21/n 1
Cell volume: 4021.3
Cell parameters: 13.809; 12.6324; 23.699; 90; 103.412; 90;

COD ID: 2312367

Formula: - C24 H22 N4 O6 U -
Comments: Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry 80(1) (2024)
Space group: P -1
Cell volume: 586.6
Cell parameters: 8.006; 8.786; 8.833; 78.274; 84.648; 74.814;

COD ID: 2312385

Formula: - C10 H13 N5 O3 -
Comments: Leonard, Peter; Zhang, Aigui; Budow-Busse, Simone; Daniliuc, Constantin; Seela, Frank α-D-2'-Deoxyadenosine, an irradiation product of canonical DNA and a component of anomeric nucleic acids: crystal structure, packing and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry 80(Pt 2) (2024) 21-29
Space group: P 1
Cell volume: 547.97
Cell parameters: 5.2027; 8.9738; 12.3715; 78.249; 83.171; 76.338;

COD ID: 2312393

Formula: - C41 H47 Br F N7 O7 S -
Comments: Yang, Haiwu; Liang, Minyi; Tian, Fang Crystal structure and Hirshfeld surface analysis of a salt of antineoplastic kinase inhibitor vandetanib. Acta crystallographica. Section C, Structural chemistry 80(3) (2024)
Space group: P -1
Cell volume: 2075.3
Cell parameters: 12.5755; 12.6649; 14.4336; 68.909; 82.733; 75.557;

COD ID: 2312394

Formula: - C22 H32.64 Ag N9 O13.32 S2 -
Comments: Al-Mahamad, Lamia L G; Clegg, William Synthesis and crystal structure of a silver(I) 6-methylmercaptopurine riboside complex. Acta crystallographica. Section C, Structural chemistry 80(3) (2024)
Space group: C 2 2 21
Cell volume: 3039.8
Cell parameters: 4.8791; 22.049; 28.256; 90; 90; 90;

COD ID: 2312395

Formula: - C52 H40 F4 N4 Pt -
Comments: Dash, Zane S.; Huang, Raymond Q.; Kimber, Ana N.; Olubajo, Opeyemi T.; Polk, Mark; Rancu, Oliver P.; Zhang, Lauren L.; Fu, Jane; Nagelj, Nejc; Reynolds, Kristopher G.; Zheng, Shao Liang; Dogutan, Dilek K. Oxygen quenching of structurally characterized [5,10,15,20-tetrakis(4-fluoro-2,6-dimethylphenyl)porphyrinato]platinum(II). Acta crystallographica. Section C, Structural chemistry 80(3) (2024)
Space group: I 4/m
Cell volume: 2692.1
Cell parameters: 17.1883; 17.1883; 9.1123; 90; 90; 90;

COD ID: 2312396

Formula: - C27 H41 N3 O5 -
Comments: Gurung, Kshitij; Šimek, Petr; Jegorov, Jr, Alexandr; Palatinus, Lukáš Structure and absolute configuration of natural fungal product beauveriolide I, isolated from Cordyceps javanica, determined by 3D electron diffraction. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 56-61
Space group: I 1 2 1
Cell volume: 5473.5
Cell parameters: 40.2744; 5.0976; 27.698; 90; 105.729; 90;

COD ID: 2312397

Formula: - C58 H52 N4 O8 -
Comments: Guerain, Mathieu; Correia, Natalia T.; Roca-Paixão, Luisa; Chevreau, Hubert; Affouard, Frederic Using synchrotron high-resolution powder X-ray diffraction for the structure determination of a new cocrystal formed by two active principle ingredients. Acta crystallographica. Section C, Structural chemistry 80(Pt 2) (2024) 37-42
Space group: P 21 21 21
Cell volume: 4755.84
Cell parameters: 33.5486; 26.4223; 5.36515; 90; 90; 90;

COD ID: 2312416

Formula: - C36 H42 Cl2 N2 O3 -
Comments: Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A. Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol. Acta crystallographica. Section C, Structural chemistry 80(Pt 4) (2024) 91-97
Space group: C 1 2/c 1
Cell volume: 3170.2
Cell parameters: 13.8926; 11.9663; 19.3872; 90; 100.384; 90;

COD ID: 2312417

Formula: - C6 H12 O6 -
Comments: Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A. Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol. Acta crystallographica. Section C, Structural chemistry 80(Pt 4) (2024) 91-97
Space group: P 1 21/n 1
Cell volume: 1502.03
Cell parameters: 6.61708; 12.0474; 18.88721; 90; 93.9791; 90;

COD ID: 2312418

Formula: - C29 H21 Br N4 O5 Zn -
Comments: Wang, Yan; Cheng, Wei Wei; Mou, Yi; Wen, Shuai; Wang, Dongkai; Xue, Yun Shan A twofold interpenetrated two-dimensional zinc(II) coordination polymer for the highly sensitive detection of nitrofurantoin in aqueous medium. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P 1 21/c 1
Cell volume: 2762
Cell parameters: 9.73; 16.52; 17.649; 90; 103.19; 90;

COD ID: 2312419

Formula: - C20 H20 N6 O -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P -1
Cell volume: 937.4
Cell parameters: 9.455; 9.628; 12.023; 69.506; 79.904; 66.215;

COD ID: 2312420

Formula: - C17 H12 N6 -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P b c a
Cell volume: 3046.3
Cell parameters: 8.5626; 18.701; 19.024; 90; 90; 90;

COD ID: 2312421

Formula: - C17 H11 Br N6 -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P -1
Cell volume: 800.3
Cell parameters: 8.551; 9.4214; 11.5813; 85.894; 70.776; 65.64;

COD ID: 2312422

Formula: - C17 H11 Cl N6 -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P -1
Cell volume: 790.3
Cell parameters: 8.5105; 9.3681; 10.8959; 81.355; 82.482; 67.388;

COD ID: 2312423

Formula: - C17 H11 F N6 -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P -1
Cell volume: 762.5
Cell parameters: 8.624; 9.503; 10.471; 80.312; 81.512; 64.78;

COD ID: 2312424

Formula: - C18 H14 N6 -
Comments: Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P b c a
Cell volume: 3265
Cell parameters: 15.7069; 11.8266; 17.5763; 90; 90; 90;

COD ID: 2312429

Formula: - C20 H14 N2 O4 -
Comments: Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P -1
Cell volume: 824.78
Cell parameters: 7.6186; 9.4985; 11.9173; 105.38; 95.005; 93.78;

COD ID: 2312430

Formula: - C13 H13 N3 O4 -
Comments: Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P 1 21 1
Cell volume: 658.25
Cell parameters: 8.2555; 6.752; 11.8096; 90; 90.573; 90;

COD ID: 2312458

Formula: - C22 H22 N2 O2 -
Comments: Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P 1 21/c 1
Cell volume: 884.01
Cell parameters: 12.8456; 5.5803; 16.7446; 90; 132.566; 90;

COD ID: 2312459

Formula: - C22 H22 N2 O2 -
Comments: Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: C 1 2/c 1
Cell volume: 3517.73
Cell parameters: 35.4947; 5.5238; 18.9927; 90; 109.151; 90;

COD ID: 2312460

Formula: - C22 H22 N2 O2 -
Comments: Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry 80(4) (2024)
Space group: P 1 21/c 1
Cell volume: 1765.16
Cell parameters: 15.0486; 9.1347; 18.5227; 90; 136.112; 90;

COD ID: 2312461

Formula: - C12 H13 N3 O4 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P 1 21 1
Cell volume: 628.154
Cell parameters: 5.8163; 6.9218; 15.6295; 90; 93.354; 90;

COD ID: 2312462

Formula: - C12 H17 N3 O7 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P -1
Cell volume: 1531.91
Cell parameters: 8.2876; 10.6404; 17.4834; 89.734; 84.793; 86.146;

COD ID: 2312463

Formula: - C12 H17 N4 O4.5 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: C 1 2/c 1
Cell volume: 2867.5
Cell parameters: 35.1636; 7.8905; 10.4972; 90; 100.091; 90;

COD ID: 2312464

Formula: - C16 H24 N4 O6 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P -1
Cell volume: 1850.43
Cell parameters: 8.4933; 13.0977; 17.1657; 90.97; 103.18; 95.132;

COD ID: 2312465

Formula: - C12 H13 N3 O4 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P c c n
Cell volume: 2558.6
Cell parameters: 12.6592; 28.3597; 7.1268; 90; 90; 90;

COD ID: 2312466

Formula: - C12 H11 K N2 O5 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P -1
Cell volume: 1360.5
Cell parameters: 5.962; 7.2033; 31.929; 83.852; 86.361; 88.868;

COD ID: 2312467

Formula: - C12 H14 K N3 O5 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P -1
Cell volume: 2933.52
Cell parameters: 13.3058; 13.6247; 18.4664; 88.373; 73.971; 66.313;

COD ID: 2312468

Formula: - C16 H22 K N3 O7 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P 1 21/n 1
Cell volume: 3922.14
Cell parameters: 9.4006; 12.1583; 34.4743; 90; 95.496; 90;

COD ID: 2312469

Formula: - C12 H9 K N2 O4 S -
Comments: Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry 80(Pt 3) (2024) 66-79
Space group: P c c n
Cell volume: 2457.2
Cell parameters: 12.5535; 27.9698; 6.9982; 90; 90; 90;

COD ID: 2312470
CIF file Original IUCr paper	Formula: - C13 H14 O5 - Comments: Decato, Daniel; Palatinus, Lukáš; Stierle, Andrea; Stierle, Donald Absolute structure determination of Berkecoumarin by X-ray and electron diffraction. Acta crystallographica. Section C, Structural chemistry 80(5) (2024) Space group: P 21 21 21 Cell volume: 1141.72 Cell parameters: 4.9524; 11.0302; 20.9007; 90; 90; 90;

COD ID: 2312471

Formula: - C44 H48 Cl6 Fe3 N16 O -
Comments: Pacholski, Roman; Durka, Krzysztof; Buchalski, Piotr Synthesis and crystal structure of an iron triazole complex resulting from the unexpected ligand cleavage of a triazolium carbene precursor. Acta crystallographica. Section C, Structural chemistry 80(5) (2024)
Space group: P -1
Cell volume: 1329.09
Cell parameters: 8.9568; 12.8555; 12.8951; 116.349; 91.178; 91.622;

COD ID: 2312472
CIF file Original IUCr paper	Formula: - C68 H56 B3 Ce Cl4 N12 O6 - Comments: Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry 80(5) (2024) Space group: P 1 21/c 1 Cell volume: 6536 Cell parameters: 11.2742; 27.1355; 21.3644; 90; 90.166; 90;

COD ID: 2312473
CIF file Original IUCr paper	Formula: - C67 H54 B3 Cl2 Dy N12 O6 - Comments: Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry 80(5) (2024) Space group: P -1 Cell volume: 3164.6 Cell parameters: 12.1461; 16.1883; 17.1795; 102.659; 103.322; 95.948;

COD ID: 2312474
CIF file Original IUCr paper	Formula: - C66 H52 B3 Dy N12 O6 - Comments: Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry 80(5) (2024) Space group: P -1 Cell volume: 2890.2 Cell parameters: 11.72; 11.9389; 21.9139; 75.579; 76.715; 86.477;

COD ID: 2312475

Formula: - Ge29.7 Mg22.3 Ni64 -
Comments: Pavlyuk, Nazar; Dmytriv, Grygoriy; Bondaruk, Alina; Ciesielski, Wojciech; Pavlyuk, Volodymyr Crystal, electronic structure and hydrogenation properties of the Mg5.57Ni16Ge7.43 cluster phase with a new type of polyhedron. Acta crystallographica. Section C, Structural chemistry 80(5) (2024)
Space group: F m -3 m
Cell volume: 1522.3
Cell parameters: 11.5036; 11.5036; 11.5036; 90; 90; 90;

COD ID: 2312476

Formula: - C6 H10 N8 O12 -
Comments: Domasevitch, Kostiantyn V.; Krautscheid, Harald Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole. Acta crystallographica. Section C, Structural chemistry 80(5) (2024)
Space group: P b c a
Cell volume: 2908.44
Cell parameters: 21.4196; 6.1927; 21.9265; 90; 90; 90;

COD ID: 2312477

Formula: - C6 H12 N8 O13 -
Comments: Domasevitch, Kostiantyn V.; Krautscheid, Harald Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole. Acta crystallographica. Section C, Structural chemistry 80(5) (2024)
Space group: P 1 21/c 1
Cell volume: 1555.67
Cell parameters: 11.2164; 20.8114; 6.6646; 90; 90.435; 90;

COD ID: 2312478

Formula: - C10 H16 Cu4 N6 O2 -
Comments: Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: C 1 2/c 1
Cell volume: 1711.52
Cell parameters: 9.6829; 8.2557; 21.4992; 90; 95.212; 90;

COD ID: 2312479

Formula: - C10 H18 Cu3 N6 O2 -
Comments: Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 21/c 1
Cell volume: 763.74
Cell parameters: 9.3903; 8.9608; 9.7986; 90; 112.134; 90;

COD ID: 2312480

Formula: - C8 H14 Cu3 N6 O2 -
Comments: Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 21/c 1
Cell volume: 696.22
Cell parameters: 9.5158; 8.8022; 9.3589; 90; 117.358; 90;

COD ID: 2312483

Formula: - C12 H16 N2 O4 -
Comments: González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 41 21 2
Cell volume: 1349.8
Cell parameters: 11.1312; 11.1312; 10.894; 90; 90; 90;

COD ID: 2312484

Formula: - C19 H24 N6 O6 -
Comments: González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 993.5
Cell parameters: 7.5284; 11.2362; 12.2606; 85.742; 76.887; 79.803;

COD ID: 2312485

Formula: - C14 H18 N4 O9 -
Comments: Guerain, Mathieu; Chevreau, Hubert; Guinet, Yannick; Paccou, Laurent; Elkaïm, Erik; Hédoux, Alain Relationship between synthesis method-crystal structure-melting properties in cocrystals: the case of caffeine-citric acid. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 848.64
Cell parameters: 14.6803; 8.8743; 6.9537; 106.922; 96.304; 97.55;

COD ID: 2312503

Formula: - C44 H34 Cl2 Mn N6 O10 -
Comments: Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 2057.68
Cell parameters: 8.93282; 12.32698; 18.86081; 89.8757; 85.6122; 83.5667;

COD ID: 2312504

Formula: - C42 H30 Cl2 Mn N6 O8 -
Comments: Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 21/c 1
Cell volume: 3698.07
Cell parameters: 9.51026; 12.5149; 31.2962; 90; 96.878; 90;

COD ID: 2312505

Formula: - C42 H30 Cl2 N6 Ni O8 -
Comments: Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 21/c 1
Cell volume: 3682.52
Cell parameters: 9.3581; 12.6255; 31.4046; 90; 97.038; 90;

COD ID: 2312506

Formula: - C18 H24 Ca O20 Zn -
Comments: Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: C 1 2/c 1
Cell volume: 2344.5
Cell parameters: 17.848; 20.106; 6.5975; 90; 97.997; 90;

COD ID: 2312507

Formula: - C18 H24 Ca Co O20 -
Comments: Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: C 1 2/c 1
Cell volume: 2332
Cell parameters: 17.875; 20.192; 6.5339; 90; 98.557; 90;

COD ID: 2312508

Formula: - C18 H30 Ca O24 Zn2 -
Comments: Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: C c c a :2
Cell volume: 2755
Cell parameters: 6.9927; 18.934; 20.808; 90; 90; 90;

COD ID: 2312509
CIF file Original IUCr paper	Formula: - C52 H68 Cu2 O24 - Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024) Space group: P c c n Cell volume: 5534.7 Cell parameters: 27.7701; 21.2278; 9.3888; 90; 90; 90;

COD ID: 2312510

Formula: - C45 H61 Cu2 N O18 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 1267.74
Cell parameters: 10.1659; 10.7383; 12.9878; 76.132; 69.646; 75.304;

COD ID: 2312511

Formula: - C40 H49 Cu2 Li O24 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 1179.87
Cell parameters: 9.7711; 10.1924; 12.5863; 73.615; 79.528; 83.412;

COD ID: 2312512
CIF file Original IUCr paper	Formula: - C43 H56 Cu2 N4 O15 - Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024) Space group: P -1 Cell volume: 1073.8 Cell parameters: 8.886; 10.702; 12.36; 73.13; 73.07; 81.68;

COD ID: 2312513
CIF file Original IUCr paper	Formula: - C85 H108 Cu4 N2 O32 - Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024) Space group: P n m a Cell volume: 8483 Cell parameters: 12.833; 54.548; 12.119; 90; 90; 90;

COD ID: 2312514

Formula: - C44 H64 Cu2 N4 O20 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 1260.15
Cell parameters: 10.4964; 10.6595; 12.3226; 97.271; 101.042; 108.13;

COD ID: 2312515

Formula: - C68 H84 Cu2 N4 O21 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P -1
Cell volume: 1754.64
Cell parameters: 10.2155; 12.0897; 15.7111; 69.581; 75.988; 79.651;

COD ID: 2312516

Formula: - C38 H30 Cu2 N2 O15 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: C 1 2/c 1
Cell volume: 3639.6
Cell parameters: 11.9851; 17.7472; 17.1294; 90; 92.637; 90;

COD ID: 2312517
CIF file Original IUCr paper	Formula: - C56 H52 Cu2 N4 O20 - Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024) Space group: P b c a Cell volume: 5717.46 Cell parameters: 17.5993; 16.4583; 19.7389; 90; 90; 90;

COD ID: 2312518

Formula: - C41 H54 Cu2 O20 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: I 1 2/a 1
Cell volume: 8720.7
Cell parameters: 19.4801; 13.0774; 34.5443; 90; 97.702; 90;

COD ID: 2312519

Formula: - C70 H120 Cu2 N4 O30 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 c 1
Cell volume: 3981.1
Cell parameters: 9.7404; 20.3001; 22.9088; 90; 118.494; 90;

COD ID: 2312520

Formula: - C13 H18 N2 O3 -
Comments: Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry 80(6) (2024)
Space group: P 1 21/n 1
Cell volume: 2603.68
Cell parameters: 15.3994; 10.6592; 16.9261; 90; 110.424; 90;

COD ID: 2312521

Formula: - C4 H4 F6 O6 S2 -
Comments: Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 278-283
Space group: P -1
Cell volume: 1078.2
Cell parameters: 10.036; 10.664; 11.276; 83.54; 64.178; 89.593;

COD ID: 2312522
CIF file Original IUCr paper	Formula: - C3 H2 F6 O6 S2 - Comments: Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 278-283 Space group: P 1 21 1 Cell volume: 474.22 Cell parameters: 8.9822; 4.9413; 10.94; 90; 102.406; 90;

COD ID: 2312523

Formula: - C16 H31 Li N2 -
Comments: Erickson, Alexander N.; Haltiwanger, Curtis; Rahim, Masoumeh; Garner, Charles M. Preferential crystallization of (±)-pinenyllithium·TMEDA. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 297-301
Space group: P -1
Cell volume: 819.83
Cell parameters: 6.316; 9.6925; 13.7463; 97.336; 99.662; 93.52;

COD ID: 2312524
CIF file Original IUCr paper	Formula: - C3 H8 N2 O4 - Comments: Hollenwäger, Dirk; Nitzer, Alexander; Bockmair, Valentin; Kornath, Andreas J. The crystal structure of the ammonium salt of 2-aminomalonic acid. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 291-296 Space group: P b c a Cell volume: 1100.81 Cell parameters: 9.9714; 9.8671; 11.1884; 90; 90; 90;

COD ID: 2312525

Formula: - C16 H24 N4 O6 -
Comments: Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 302-310
Space group: P -1
Cell volume: 462.18
Cell parameters: 6.8383; 7.2272; 9.7427; 82.921; 76.809; 82.043;

COD ID: 2312526

Formula: - C13 H13 Cl N2 O3 -
Comments: Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 302-310
Space group: P 1 21/c 1
Cell volume: 1287.27
Cell parameters: 11.7399; 8.3731; 13.6779; 90; 106.782; 90;

COD ID: 2312527

Formula: - C49 H39 F6 N2 O P3 Ru -
Comments: Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 319-330
Space group: P 1 21/n 1
Cell volume: 4854.6
Cell parameters: 10.5442; 21.1741; 21.9326; 90; 97.528; 90;

COD ID: 2312528

Formula: - C51 H43 F6 N2 O P3 Ru -
Comments: Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 319-330
Space group: P -1
Cell volume: 2265.6
Cell parameters: 11.7657; 14.1033; 14.9728; 94.141; 97.381; 111.957;

COD ID: 2312529

Formula: - C51 H43 F6 N2 O P3 Ru -
Comments: Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 319-330
Space group: P 1 21/c 1
Cell volume: 5307.9
Cell parameters: 14.9624; 21.9572; 17.1148; 90; 109.266; 90;

COD ID: 2312530
CIF file Original IUCr paper	Formula: - C12 H26 I14 N2 Pd2 S4 - Comments: Blake, Alexander J.; Castellano, Carlo; Lippolis, Vito; Podda, Enrico; Schröder, Martin Formation of extended polyiodides at large cation templates. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 311-318 Space group: C 1 2/c 1 Cell volume: 4211.1 Cell parameters: 21.609; 8.198; 24.151; 90; 100.17; 90;

COD ID: 2312531
CIF file Original IUCr paper	Formula: - C19 H40 Cl2 I9 N2 O6 - Comments: Blake, Alexander J.; Castellano, Carlo; Lippolis, Vito; Podda, Enrico; Schröder, Martin Formation of extended polyiodides at large cation templates. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 311-318 Space group: P 1 21/n 1 Cell volume: 4125.7 Cell parameters: 13.831; 14.82; 20.266; 90; 96.7; 90;

COD ID: 2312532

Formula: - C18 H34 N2 O12 -
Comments: Shit, Pradip; Tetrault, Timothy; Zhang, Wenhui; Yoon, Mi Kyung; Oliver, Allen G.; Serianni, Anthony S. Conformational disorder in the crystal structure of methyl 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranoside (methyl β-chitobioside) methanol monosolvate. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 331-336
Space group: P 1 21 1
Cell volume: 1135.18
Cell parameters: 4.7599; 14.3223; 16.6515; 90; 90.022; 90;

COD ID: 2312536

Formula: - C26 H22 Mn O2 P S -
Comments: Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C5HxBry(SMe)z}(PPh3)(CO)2]. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/c 1
Cell volume: 2332.65
Cell parameters: 7.7281; 16.8523; 18.0339; 90; 96.696; 90;

COD ID: 2312537

Formula: - C27 H23 Br Mn O2 P S2 -
Comments: Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C5HxBry(SMe)z}(PPh3)(CO)2]. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P b c a
Cell volume: 5199
Cell parameters: 16.5563; 16.2392; 19.3372; 90; 90; 90;

COD ID: 2312538

Formula: - C28 H25 Br Mn O2 P S3 -
Comments: Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C5HxBry(SMe)z}(PPh3)(CO)2]. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/n 1
Cell volume: 2771.6
Cell parameters: 8.7717; 13.2135; 23.9428; 90; 92.884; 90;

COD ID: 2312539

Formula: - C30 H30 Mn O2 P S5 -
Comments: Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C5HxBry(SMe)z}(PPh3)(CO)2]. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/c 1
Cell volume: 2931.2
Cell parameters: 12.5274; 13.6748; 17.9841; 90; 107.934; 90;

COD ID: 2312540

Formula: - C56.5 H51 Br2 Mn2 O4 P2 S2 -
Comments: Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C5HxBry(SMe)z}(PPh3)(CO)2]. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P -1
Cell volume: 1278.93
Cell parameters: 10.3309; 10.7727; 13.0821; 87.692; 82.138; 62.507;

COD ID: 2312541

Formula: - C25 H21 Cl N2 O4 S -
Comments: Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P b c a
Cell volume: 4705.25
Cell parameters: 10.792; 18.713; 23.299; 90; 90; 90;

COD ID: 2312542

Formula: - C25 H20 Cl F N2 O4 S -
Comments: Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P b c a
Cell volume: 4733.4
Cell parameters: 10.536; 19.246; 23.343; 90; 90; 90;

COD ID: 2312543

Formula: - C25 H20 Cl N3 O6 S -
Comments: Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P -1
Cell volume: 1236.5
Cell parameters: 7.489; 8.302; 21.384; 93.03; 91.61; 111.17;

COD ID: 2312544

Formula: - C14 H12 F2 N2 O2 -
Comments: Sánchez-Pacheco, Addi Dana; Huerta, Eduardo H.; Espinosa-Camargo, Josué Benjamín; Rodríguez-Nájera, Evelyn Valeria; Martínez-Otero, Diego; Hernández-Ortega, Simón; Valdés-Martínez, Jesús Using cocrystals as a tool to study non-crystallizing molecules: crystal structure, Hirshfeld surface analysis and computational study of the 1:1 cocrystal of (E)-N-(3,4-difluorophenyl)-1-(pyridin-4-yl)methanimine and acetic acid. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P -1
Cell volume: 633.42
Cell parameters: 3.8047; 11.0101; 15.4968; 79.535; 89.223; 82.88;

COD ID: 2312545

Formula: - C12 H9 N O5 -
Comments: Palme, Paul R.; Goddard, Richard; Richter, Adrian; Imming, Peter; Seidel, Rüdiger W 3-[(Benzo-1,3-dioxol-5-yl)amino]-4-methoxycyclobut-3-ene-1,2-dione: polymorphism and twinning of a precursor to an antimycobacterial squaramide. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/c 1
Cell volume: 2079.57
Cell parameters: 13.0541; 13.4304; 13.1257; 90; 115.354; 90;

COD ID: 2312546

Formula: - C12 H9 N O5 -
Comments: Palme, Paul R.; Goddard, Richard; Richter, Adrian; Imming, Peter; Seidel, Rüdiger W 3-[(Benzo-1,3-dioxol-5-yl)amino]-4-methoxycyclobut-3-ene-1,2-dione: polymorphism and twinning of a precursor to an antimycobacterial squaramide. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P -1
Cell volume: 1040
Cell parameters: 3.7001; 12.4583; 22.846; 89.55; 86.967; 81.46;

COD ID: 2312547

Formula: - C66 H106 Er N5 O17.5 S3 -
Comments: Araujo Junior, Cleber R.; Oliveira, Willian X. C.; Pinheiro, Carlos B.; Pedroso, Emerson F.; Nunes, Wallace C.; Almeida, Adriele A de; Knobel, Marcelo; Julve, Miguel; Pereira, Cynthia L. M. Crystal structure and cryomagnetic study of a mononuclear erbium(III) oxamate inclusion complex. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/n 1
Cell volume: 7585.35
Cell parameters: 15.3967; 30.6741; 16.0612; 90; 90.172; 90;

COD ID: 2312548

Formula: - C27 H22 Br2 Co N3 O2 S3 -
Comments: Mandal, Uttam; Rizzoli, Corrado; Chakraborty, Bikash; Bandyopadhyay, Debasis; Mandal, Santanu A novel one-dimensional thiocyanate-bridged cobalt(III) complex: synthesis, crystal structure characterization and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P c a 21
Cell volume: 2949.9
Cell parameters: 16.5337; 13.2578; 13.4575; 90; 90; 90;

COD ID: 2312549
CIF file Original IUCr paper	Formula: - F7 Ge H2 Na - Comments: Bockmair, Valentin; Hoch, Constantin; Schusterbauer, Irina; Kornath, Andreas J. Na[GeF<sub>5</sub>]·2HF: the first quarternary phase in the H-Na-Ge-F system. Acta crystallographica. Section C, Structural chemistry 80(8) (2024) Space group: P c a 21 Cell volume: 1027.36 Cell parameters: 12.3786; 7.2189; 11.4969; 90; 90; 90;

COD ID: 2312550

Formula: - C29 H40 O9 -
Comments: Asmaey, Mostafa A.; Kalofolias, Dimitris A.; Charavgi, Maria Despoina; Abdel-Rahim, Ismail R; Chrysina, Evangelia D.; Abatis, Dennis Crystal structure of the cytotoxic macrocyclic trichothecene Isororidin A. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 21 21 21
Cell volume: 2834
Cell parameters: 9.2707; 15.2236; 20.0806; 90; 90; 90;

COD ID: 2312551

Formula: - C29 H40 O9 -
Comments: Asmaey, Mostafa A.; Kalofolias, Dimitris A.; Charavgi, Maria Despoina; Abdel-Rahim, Ismail R; Chrysina, Evangelia D.; Abatis, Dennis Crystal structure of the cytotoxic macrocyclic trichothecene Isororidin A. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 21 21 21
Cell volume: 2894.6
Cell parameters: 9.302; 15.412; 20.191; 90; 90; 90;

COD ID: 2312552

Formula: - C52 H56 Cl4 Mn2 O6 P4 -
Comments: Li, Jia Wei; Niu, Mengyuan; Feng, Wei; Dong, Wenke; Liu, Yanjie; Yang, Jingjing; Wang, Chunjie; Zhang, Hui; Song, Wei Wu Synthesis, structure and red-light emission of a manganese halide directed by a methyldiphenylphosphine oxide complex. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: I 41/a :2
Cell volume: 5374.61
Cell parameters: 21.0944; 21.0944; 12.0785; 90; 90; 90;

COD ID: 2312553

Formula: - C14 H10 Br N3 -
Comments: Qin, Qiaoqi; Liu, Jiamin; Luan, Xinyu; Xu, Jianqiao; Jiang, Long Crystal structure and Hirshfeld surface analysis of two iHOFs based on CH...NC hydrogen bonding. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P n m a
Cell volume: 1222.79
Cell parameters: 8.7734; 7.0554; 19.7544; 90; 90; 90;

COD ID: 2312554

Formula: - C28 H20 Br5 N6 Sb -
Comments: Qin, Qiaoqi; Liu, Jiamin; Luan, Xinyu; Xu, Jianqiao; Jiang, Long Crystal structure and Hirshfeld surface analysis of two iHOFs based on CH...NC hydrogen bonding. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: I 4/m
Cell volume: 4149.5
Cell parameters: 23.8054; 23.8054; 7.3222; 90; 90; 90;

COD ID: 2312555

Formula: - C6 H12 N6 O S2 -
Comments: Wzgarda-Raj, Kinga; Olszewski, Adrian; Palusiak, Marcin The pattern of bifurcated hydrogen bonds in thiourea cocrystals with diazine derivatives: experimental and quantum theoretical studies. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/c 1
Cell volume: 1185.75
Cell parameters: 9.5521; 13.9524; 9.9961; 90; 117.12; 90;

COD ID: 2312556

Formula: - C45 H40 N13 S3 -
Comments: Wzgarda-Raj, Kinga; Olszewski, Adrian; Palusiak, Marcin The pattern of bifurcated hydrogen bonds in thiourea cocrystals with diazine derivatives: experimental and quantum theoretical studies. Acta crystallographica. Section C, Structural chemistry 80(8) (2024)
Space group: P 1 21/c 1
Cell volume: 4100.9
Cell parameters: 25.5771; 11.7896; 13.6126; 90; 92.484; 90;

COD ID: 2312557

Formula: - C3 H7 N O2 -
Comments: Kumar, Anil; Jha, Kunal Kumar; Olech, Barbara; Goral, Tomasz; Malinska, Maura; Woźniak, Krzysztof; Dominiak, Paulina Maria TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 264-277
Space group: P 21 21 21
Cell volume: 431
Cell parameters: 5.89; 5.99; 12.22; 90; 90; 90;

COD ID: 2312558

COD ID: 2312559

Formula: - C2 H5 N O2 -
Comments: Kumar, Anil; Jha, Kunal Kumar; Olech, Barbara; Goral, Tomasz; Malinska, Maura; Woźniak, Krzysztof; Dominiak, Paulina Maria TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 264-277
Space group: P 1 21/n 1
Cell volume: 302
Cell parameters: 5.11; 11.81; 5.44; 90; 113.1; 90;

COD ID: 2312560

COD ID: 2312561

Formula: - C H4 N2 O -
Comments: Kumar, Anil; Jha, Kunal Kumar; Olech, Barbara; Goral, Tomasz; Malinska, Maura; Woźniak, Krzysztof; Dominiak, Paulina Maria TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. Acta crystallographica. Section C, Structural chemistry 80(Pt 7) (2024) 264-277
Space group: P -4 21 m
Cell volume: 147.7
Cell parameters: 5.596; 5.596; 4.7164; 90; 90; 90;

COD ID: 2312562

COD ID: 2312563

Formula: - C55 H42 F18 Fe2 N15 P3 -
Comments: Schlachta, Tim P.; Sauer, Michael J.; Richter, Leon F.; Kühn, Fritz E Formation of a diiron-(μ-η1:η1-CN) complex from acetonitrile solution. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: C 1 2/c 1
Cell volume: 6011.7
Cell parameters: 25.562; 17.0373; 14.8998; 90; 112.112; 90;

COD ID: 2312564
CIF file Original IUCr paper	Formula: - C16 H19 Cl N2 O2 - Comments: Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P 1 21/n 1 Cell volume: 2292.69 Cell parameters: 7.7936; 18.3639; 16.3922; 90; 102.245; 90;

COD ID: 2312565
CIF file Original IUCr paper	Formula: - C16 H19 Br N2 O2 - Comments: Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P -1 Cell volume: 1186.86 Cell parameters: 7.8794; 9.7748; 16.272; 104.385; 98.342; 96.386;

COD ID: 2312566
CIF file Original IUCr paper	Formula: - C16 H19 I3 N2 O2 - Comments: Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P -1 Cell volume: 500.61 Cell parameters: 7.3766; 8.8131; 9.3226; 113.612; 103.144; 104.263;

COD ID: 2312567
CIF file Original IUCr paper	Formula: - C16 H19 B F4 N2 O2 - Comments: Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P -1 Cell volume: 844.555 Cell parameters: 7.107; 9.5381; 13.3592; 98.765; 98.034; 105.977;

COD ID: 2312568
CIF file Original IUCr paper	Formula: - C16 H19 Br0.93 I3.07 N2 O2 - Comments: Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P 1 21/m 1 Cell volume: 2190.47 Cell parameters: 5.8956; 18.6224; 19.9632; 90; 91.97; 90;

COD ID: 2312569

Formula: - C8 H14 Mn O12 -
Comments: Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Further evaluation of the shape of atomic Hirshfeld surfaces: M...H contacts and homoatomic bonds. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 330.69
Cell parameters: 5.3263; 7.3743; 9.3688; 109.863; 104.606; 93.344;

COD ID: 2312570

Formula: - C8 H14 Co O12 -
Comments: Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Further evaluation of the shape of atomic Hirshfeld surfaces: M...H contacts and homoatomic bonds. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 319.76
Cell parameters: 5.2222; 7.3322; 9.2293; 109.125; 104.376; 93.224;

COD ID: 2312571

Formula: - C8 H14 Ni O12 -
Comments: Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Further evaluation of the shape of atomic Hirshfeld surfaces: M...H contacts and homoatomic bonds. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 315.25
Cell parameters: 5.178; 7.3254; 9.1449; 108.423; 104.583; 92.929;

COD ID: 2312572

Formula: - C8 H14 O12 Zn -
Comments: Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Further evaluation of the shape of atomic Hirshfeld surfaces: M...H contacts and homoatomic bonds. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 320.23
Cell parameters: 5.2307; 7.3259; 9.2246; 108.753; 104.626; 93.202;

COD ID: 2312573

Formula: - C18 H14 Br2 N6 O Zn -
Comments: Dailey, Maegan; Jackson, Eric W.; Ramadhar, Timothy R. Crystal structures, phase transition, and Hirshfeld surface analyses of the bromide and chloride congeners of aqua[2,4,6-tris(pyridin-4-yl)-1,3,5-triazine]zinc(II) halide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P n m a
Cell volume: 2074.09
Cell parameters: 14.4614; 14.1299; 10.1503; 90; 90; 90;

COD ID: 2312574

Formula: - C18 H14 Br2 N6 O Zn -
Comments: Dailey, Maegan; Jackson, Eric W.; Ramadhar, Timothy R. Crystal structures, phase transition, and Hirshfeld surface analyses of the bromide and chloride congeners of aqua[2,4,6-tris(pyridin-4-yl)-1,3,5-triazine]zinc(II) halide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/m 1
Cell volume: 2018.44
Cell parameters: 9.9449; 14.1246; 14.3921; 90; 93.216; 90;

COD ID: 2312575

Formula: - C18 H14 Cl2 N6 O Zn -
Comments: Dailey, Maegan; Jackson, Eric W.; Ramadhar, Timothy R. Crystal structures, phase transition, and Hirshfeld surface analyses of the bromide and chloride congeners of aqua[2,4,6-tris(pyridin-4-yl)-1,3,5-triazine]zinc(II) halide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P n m a
Cell volume: 1956.1
Cell parameters: 14.1507; 14.0162; 9.8624; 90; 90; 90;

COD ID: 2312576

Formula: - C20 H20 Cl4 I2 N4 -
Comments: Bosch, Eric; Bowling, Nathan P. Role of secondary interactions in a series of 2:1 halogen-bonded cocrystals formed between 4-(dimethylamino)pyridine and ditopic halogen-bond donors. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 594.91
Cell parameters: 8.168; 9.129; 9.8118; 103.727; 107.165; 112.18;

COD ID: 2312577

Formula: - C20 H20 Br4 I2 N4 -
Comments: Bosch, Eric; Bowling, Nathan P. Role of secondary interactions in a series of 2:1 halogen-bonded cocrystals formed between 4-(dimethylamino)pyridine and ditopic halogen-bond donors. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 612.84
Cell parameters: 8.3361; 9.3089; 9.8204; 102.484; 108.399; 113.064;

COD ID: 2312578

Formula: - C20 H20 Br F4 I N4 -
Comments: Bosch, Eric; Bowling, Nathan P. Role of secondary interactions in a series of 2:1 halogen-bonded cocrystals formed between 4-(dimethylamino)pyridine and ditopic halogen-bond donors. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/c 1
Cell volume: 1083.58
Cell parameters: 7.3898; 16.212; 9.4236; 90; 106.304; 90;

COD ID: 2312579

Formula: - C20 H20 Br2 F2 I2 N4 -
Comments: Bosch, Eric; Bowling, Nathan P. Role of secondary interactions in a series of 2:1 halogen-bonded cocrystals formed between 4-(dimethylamino)pyridine and ditopic halogen-bond donors. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 1175.73
Cell parameters: 9.6158; 9.7518; 14.8423; 74.473; 85.82; 61.476;

COD ID: 2312580
CIF file	Formula: - C17 H19 Cl F18 O5 Ti - Comments: Van Der Sluys, William G. Concerning the structures of Lewis base adducts of titanium(IV) hexafluoroisopropoxide. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P 1 21/c 1 Cell volume: 2665.9 Cell parameters: 14.05; 10.701; 18.692; 90; 108.45; 90;

COD ID: 2312581

Formula: - C15 H3 F18 Fe O6 -
Comments: Chang, Joyce; Defeo, Julianna N.; Wei, Zheng; Dikarev, Evgeny V. Two polymorph modifications of tris(hexafluoroacetylacetonato)iron(III) revealed: is that common for other trivalent metals? Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/n 1
Cell volume: 2180.91
Cell parameters: 8.7659; 12.9796; 19.1759; 90; 91.632; 90;

COD ID: 2312582

Formula: - C15 H3 F18 Fe O6 -
Comments: Chang, Joyce; Defeo, Julianna N.; Wei, Zheng; Dikarev, Evgeny V. Two polymorph modifications of tris(hexafluoroacetylacetonato)iron(III) revealed: is that common for other trivalent metals? Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -3
Cell volume: 3328.55
Cell parameters: 18.1141; 18.1141; 11.7136; 90; 90; 120;

COD ID: 2312583

Formula: - C30 H38 Cl2 Cu3 N16 O13 -
Comments: Atencio, Reinaldo; Linares, Marciel M.; González, Teresa; Briceño, Alexander Multivalent hydrogen-bonded architectures directed by self-complementarity between [Cu(2,2'-biimidazole)] and malonate building blocks. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: C c c a :2
Cell volume: 8508
Cell parameters: 13.766; 20.162; 30.654; 90; 90; 90;

COD ID: 2312584

Formula: - C9 H14 Cu N4 O7 -
Comments: Atencio, Reinaldo; Linares, Marciel M.; González, Teresa; Briceño, Alexander Multivalent hydrogen-bonded architectures directed by self-complementarity between [Cu(2,2'-biimidazole)] and malonate building blocks. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/c 1
Cell volume: 2715.8
Cell parameters: 7.0587; 20.3107; 18.9523; 90; 91.77; 90;

COD ID: 2312585

Formula: - C30 H32.4 Cl2 Cu3 N16 O20.2 -
Comments: Atencio, Reinaldo; Linares, Marciel M.; González, Teresa; Briceño, Alexander Multivalent hydrogen-bonded architectures directed by self-complementarity between [Cu(2,2'-biimidazole)] and malonate building blocks. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: C 1 2/c 1
Cell volume: 4546.7
Cell parameters: 17.9569; 15.2466; 16.6781; 90; 95.296; 90;

COD ID: 2312586

Formula: - C48 H72 Cu3 N24 O29 -
Comments: Atencio, Reinaldo; Linares, Marciel M.; González, Teresa; Briceño, Alexander Multivalent hydrogen-bonded architectures directed by self-complementarity between [Cu(2,2'-biimidazole)] and malonate building blocks. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/c 1
Cell volume: 3165.5
Cell parameters: 7.7912; 12.5972; 32.481; 90; 96.802; 90;

COD ID: 2312587

Formula: - C26 H30 N4 O4 S2 -
Comments: Dival, Bruno; Pitinato, Leonardo; Develly, Letícia; Oliveira, Willian X. C. Crystal structures of two unexpected products of vicinal diamines left to crystallize in acetone. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: C 1 2/c 1
Cell volume: 5400.6
Cell parameters: 30.0416; 9.7018; 24.0984; 90; 129.744; 90;

COD ID: 2312588

Formula: - C26 H31.6 Cl N4 O4.3 S2 -
Comments: Dival, Bruno; Pitinato, Leonardo; Develly, Letícia; Oliveira, Willian X. C. Crystal structures of two unexpected products of vicinal diamines left to crystallize in acetone. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P 1 21/c 1
Cell volume: 2740.94
Cell parameters: 12.0993; 13.4307; 17.3586; 90; 103.667; 90;

COD ID: 2312589
CIF file Original IUCr paper	Formula: - C45 H57 N25 Ti2 - Comments: Bikzhanova, Galina A.; Guzei, Ilia A. Coordination variety of phenyltetrazolato and dimethylamido ligands in dimeric Ti, Zr, and Ta complexes. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P 1 21/c 1 Cell volume: 5880 Cell parameters: 11.6292; 22.6611; 22.3631; 90; 93.857; 90;

COD ID: 2312590
CIF file Original IUCr paper	Formula: - C57.09 H63.47 Cl0.76 N28 Zr2 - Comments: Bikzhanova, Galina A.; Guzei, Ilia A. Coordination variety of phenyltetrazolato and dimethylamido ligands in dimeric Ti, Zr, and Ta complexes. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P -1 Cell volume: 6305.3 Cell parameters: 13.9631; 16.7619; 27.3054; 86.902; 81.154; 89.969;

COD ID: 2312591
CIF file Original IUCr paper	Formula: - C65.75 H70 N36 O Ta2 - Comments: Bikzhanova, Galina A.; Guzei, Ilia A. Coordination variety of phenyltetrazolato and dimethylamido ligands in dimeric Ti, Zr, and Ta complexes. Acta crystallographica. Section C, Structural chemistry 80(9) (2024) Space group: P 1 21/n 1 Cell volume: 15041.8 Cell parameters: 22.5131; 25.5101; 26.7165; 90; 101.383; 90;

COD ID: 2312592

Formula: - C26 H34 Cu N4 O10 -
Comments: Guimaraes, Samuel P.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Coordination structure and intermolecular interactions in copper(II) acetate complexes with 1,10-phenanthroline and 2,2'-bipyridine. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 1470.03
Cell parameters: 8.1778; 12.3323; 15.9879; 69.166; 77.689; 88.572;

COD ID: 2312593

Formula: - C26 H32 Cu N4 O9 -
Comments: Guimaraes, Samuel P.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Coordination structure and intermolecular interactions in copper(II) acetate complexes with 1,10-phenanthroline and 2,2'-bipyridine. Acta crystallographica. Section C, Structural chemistry 80(9) (2024)
Space group: P -1
Cell volume: 1407.8
Cell parameters: 11.0826; 11.184; 12.188; 86.537; 69.82; 83.261;

COD ID: 2312596

Formula: - C14 H10 Ba N2 O10 -
Comments: Ding, Xin Yu; Yu, Hai Yan; Zhang, Hong Tao; Wang, Xiao Long A new three-dimensional barium(II) coordination polymer constructed from N,N'-bis(glycinyl)pyromellitic diimide: microwave-assisted synthesis, structure, Hirshfeld surface analysis and properties. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P -1
Cell volume: 803.76
Cell parameters: 7.3856; 8.408; 14.5603; 75.415; 76.628; 68.377;

COD ID: 2312597

Formula: - C14 H10 Cd N2 O10 -
Comments: Zhang, Zheng; Zhao, Lei; Yu, Hai Yan; Zhang, Hong Tao 2D coordination polymers of cadmium(II) and zinc(II) derived from N,N'-bis(glycinyl)pyromellitic diimide: microwave-assisted synthesis, structures, spectroscopic properties and influence of metal-ion size. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P -1
Cell volume: 373.7
Cell parameters: 4.9317; 5.441; 14.014; 84.255; 88.521; 87.532;

COD ID: 2312598

Formula: - C14 H12 N2 O11 Zn -
Comments: Zhang, Zheng; Zhao, Lei; Yu, Hai Yan; Zhang, Hong Tao 2D coordination polymers of cadmium(II) and zinc(II) derived from N,N'-bis(glycinyl)pyromellitic diimide: microwave-assisted synthesis, structures, spectroscopic properties and influence of metal-ion size. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P 1 21/n 1
Cell volume: 1590.8
Cell parameters: 10.768; 5.0511; 29.334; 90; 94.409; 90;

COD ID: 2312599
CIF file Original IUCr paper	Formula: - C24 H12 B Cl N6 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P n m a Cell volume: 1836.3 Cell parameters: 12.0315; 14.8174; 10.3002; 90; 90; 90;

COD ID: 2312600
CIF file Original IUCr paper	Formula: - C24 H12 B Br N6 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P n m a Cell volume: 1877.67 Cell parameters: 12.001; 15.0617; 10.3879; 90; 90; 90;

COD ID: 2312601
CIF file Original IUCr paper	Formula: - C25 H15 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P n m a Cell volume: 1953.9 Cell parameters: 12.3162; 15.2325; 10.4151; 90; 90; 90;

COD ID: 2312602
CIF file Original IUCr paper	Formula: - C26 H17 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/n 1 Cell volume: 2064.2 Cell parameters: 9.0313; 14.22; 16.474; 90; 102.667; 90;

COD ID: 2312603
CIF file Original IUCr paper	Formula: - C26 H17 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/n 1 Cell volume: 2065.1 Cell parameters: 9.0304; 14.2423; 16.4452; 90; 102.476; 90;

COD ID: 2312604
CIF file Original IUCr paper	Formula: - C26 H14 B F3 N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/c 1 Cell volume: 2179.3 Cell parameters: 10.4664; 15.4986; 14.3171; 90; 110.221; 90;

COD ID: 2312605
CIF file Original IUCr paper	Formula: - C28 H21 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P b c a Cell volume: 4594 Cell parameters: 14.6398; 15.2842; 20.5313; 90; 90; 90;

COD ID: 2312606
CIF file Original IUCr paper	Formula: - C28 H21 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/c 1 Cell volume: 2310.55 Cell parameters: 14.3815; 8.2702; 19.866; 90; 102.074; 90;

COD ID: 2312607
CIF file Original IUCr paper	Formula: - C192 H178 B6 N36 O7 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P -1 Cell volume: 4003 Cell parameters: 15.3028; 16.2278; 17.3604; 103.045; 105.716; 94.022;

COD ID: 2312608
CIF file Original IUCr paper	Formula: - C30 H17 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P -1 Cell volume: 1133.6 Cell parameters: 10.0268; 10.7263; 11.809; 85.879; 77.44; 66.151;

COD ID: 2312609
CIF file Original IUCr paper	Formula: - C34 H19 B N6 O - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P n m a Cell volume: 2474 Cell parameters: 17.133; 13.929; 10.3669; 90; 90; 90;

COD ID: 2312610
CIF file Original IUCr paper	Formula: - C26 H15 B N6 O2 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P -1 Cell volume: 1024.69 Cell parameters: 9.3432; 9.3548; 12.3322; 104.203; 100.751; 90.701;

COD ID: 2312611
CIF file Original IUCr paper	Formula: - C31 H17 B N6 O2 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/c 1 Cell volume: 2414.3 Cell parameters: 15.671; 11.192; 15.2363; 90; 115.386; 90;

COD ID: 2312612
CIF file Original IUCr paper	Formula: - C27 H21 B N6 O Si - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/c 1 Cell volume: 2408.4 Cell parameters: 16.343; 11.9655; 12.5059; 90; 99.996; 90;

COD ID: 2312613
CIF file Original IUCr paper	Formula: - C30 H12 B F5 N6 S - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P -1 Cell volume: 2552.1 Cell parameters: 10.701; 11.8651; 22.4968; 95.863; 92.861; 115.433;

COD ID: 2312614
CIF file Original IUCr paper	Formula: - C31 H19 B N6 S - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: C 1 2/c 1 Cell volume: 15059 Cell parameters: 49.653; 12.1268; 27.559; 90; 114.838; 90;

COD ID: 2312615
CIF file Original IUCr paper	Formula: - C31 H20.28 B N7 O0.14 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P -1 Cell volume: 2417.05 Cell parameters: 11.4897; 11.7489; 19.3046; 73.348; 81.941; 76.167;

COD ID: 2312616
CIF file Original IUCr paper	Formula: - C31 H20 B N7 - Comments: Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P. The influence of the axial group on the crystal structures of boron subphthalocyanines. Acta crystallographica. Section C, Structural chemistry 80(10) (2024) Space group: P 1 21/c 1 Cell volume: 2395.8 Cell parameters: 10.3502; 20.7509; 12.2816; 90; 114.734; 90;

COD ID: 2312617

Formula: - C4 H12 Ca O10 -
Comments: Polo, Alvaro; Soriano, Alejandro; Rodríguez, Ricardo; Macías, Ramón; García-Orduña, Pilar; Sanz Miguel, Pablo J. Revisiting a natural wine salt: calcium (2R,3R)-tartrate tetrahydrate. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P 21 21 21
Cell volume: 919.24
Cell parameters: 9.1587; 9.5551; 10.5041; 90; 90; 90;

COD ID: 2312618

Formula: - C24 H35 N2 O6.5 -
Comments: Liu, Jiyong; Shi, Dier; Yu, Kaxi; Liu, Shuna; Chen, Linshen; Hu, Xiurong Crystal structures and properties of derivatives of the alkaloid matrine: salts and hydrate forms. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P 21 21 21
Cell volume: 2306.37
Cell parameters: 8.1508; 11.0066; 25.7084; 90; 90; 90;

COD ID: 2312619

Formula: - C22 H32 N2 O5 -
Comments: Liu, Jiyong; Shi, Dier; Yu, Kaxi; Liu, Shuna; Chen, Linshen; Hu, Xiurong Crystal structures and properties of derivatives of the alkaloid matrine: salts and hydrate forms. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P 21 21 21
Cell volume: 2076.39
Cell parameters: 9.2999; 12.7329; 17.5349; 90; 90; 90;

COD ID: 2312620

Formula: - C15 H27.5 N2 O2.75 -
Comments: Liu, Jiyong; Shi, Dier; Yu, Kaxi; Liu, Shuna; Chen, Linshen; Hu, Xiurong Crystal structures and properties of derivatives of the alkaloid matrine: salts and hydrate forms. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P 43 21 2
Cell volume: 3020.64
Cell parameters: 11.7364; 11.7364; 21.9295; 90; 90; 90;

COD ID: 2312621

Formula: - C48 H64 Cu2 O18 -
Comments: Bermúdez, Mariano Marziali; Muller, Federico G.; Baggio, Ricardo; Cukiernik, Fabio D. Synthesis, crystal structure, magnetic behaviour and thermal stability of a paddle-wheel copper(II) complex bearing equatorial 3,4-diethoxybenzoate ligands. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: P -1
Cell volume: 3922.9
Cell parameters: 13.3799; 13.7269; 21.7569; 83.135; 81.967; 86.064;

COD ID: 2312622

Formula: - C66 H86.67 N12 Nd4 O51.33 S6 -
Comments: Calisto, Victoria F. M.; De Abreu, Heitor A.; Diniz, Renata Experimental and theoretical structural investigation of an ionic Nd coordination polymer. Acta crystallographica. Section C, Structural chemistry 80(10) (2024)
Space group: C 1 2/c 1
Cell volume: 9224.57
Cell parameters: 44.4766; 21.3079; 10.3339; 90; 109.625; 90;

COD ID: 2312649

Formula: - C26 H29 N7 O4 -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Structural insights into supramolecular interactions in isostructural salts of 2,4,6-triaminopyrimidinium with various heterocyclic carboxylates. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 734-741
Space group: P 1 21/c 1
Cell volume: 2430.1
Cell parameters: 5.6392; 13.4963; 31.968; 90; 92.79; 90;

COD ID: 2312650

Formula: - C14 H16 N6 O2 -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Structural insights into supramolecular interactions in isostructural salts of 2,4,6-triaminopyrimidinium with various heterocyclic carboxylates. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 734-741
Space group: P -1
Cell volume: 1417
Cell parameters: 11.5487; 11.5859; 11.9737; 69.595; 73.659; 74.862;

COD ID: 2312651

Formula: - C9 H10 Br N5 O2 S -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Structural insights into supramolecular interactions in isostructural salts of 2,4,6-triaminopyrimidinium with various heterocyclic carboxylates. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 734-741
Space group: P -1
Cell volume: 1201.61
Cell parameters: 8.4348; 10.5501; 14.0931; 77.558; 86.82; 78.896;

COD ID: 2312652

Formula: - C9 H10 Cl N5 O2 S -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Structural insights into supramolecular interactions in isostructural salts of 2,4,6-triaminopyrimidinium with various heterocyclic carboxylates. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 734-741
Space group: P -1
Cell volume: 1172.28
Cell parameters: 8.3306; 10.4403; 14.0361; 78.406; 87.357; 78.608;

COD ID: 2312653
CIF file Original IUCr paper	Formula: - C24 H22 Fe O2 S2 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P 1 21 1 Cell volume: 1058.16 Cell parameters: 7.8964; 12.9064; 11.0124; 90; 109.467; 90;

COD ID: 2312654
CIF file Original IUCr paper	Formula: - C24 H22 Fe O2 S2 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P 1 21 1 Cell volume: 2108.5 Cell parameters: 17.1882; 6.0383; 20.4271; 90; 95.995; 90;

COD ID: 2312655
CIF file Original IUCr paper	Formula: - C31 H28 Fe O3 S3 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P 1 Cell volume: 1334.02 Cell parameters: 7.8298; 9.8573; 17.4937; 93.379; 91.12; 98.051;

COD ID: 2312656
CIF file Original IUCr paper	Formula: - C41 H40 Fe O5.5 S4 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P 1 21 1 Cell volume: 3838.6 Cell parameters: 12.8893; 8.2225; 36.5; 90; 97.106; 90;

COD ID: 2312657
CIF file Original IUCr paper	Formula: - C22 H18 Fe S2 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P m n 21 Cell volume: 893.44 Cell parameters: 14.0977; 7.1607; 8.8504; 90; 90; 90;

COD ID: 2312658
CIF file Original IUCr paper	Formula: - C34 H26 Fe S4 - Comments: Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 716-727 Space group: P -1 Cell volume: 1412.15 Cell parameters: 8.4836; 10.3028; 16.721; 90.73; 103.948; 94.999;

COD ID: 2312659

Formula: - C28 H24 N4 O4 S2 Zn2 -
Comments: Anaya-Avila, Odalys; Muñoz-Granados, Oscar; Andrade-López, Noemí; Alvarado-Rodríguez, José G; Martínez-Otero, Diego Dinuclear zinc(II) acetate complexes derived from N,N',S-tridentate Schiff bases: synthesis, structural study and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 698-706
Space group: P -1
Cell volume: 653.41
Cell parameters: 8.3263; 9.011; 9.8712; 63.454; 84.9942; 80.5169;

COD ID: 2312660

Formula: - C30 H28 N4 O4 S2 Zn2 -
Comments: Anaya-Avila, Odalys; Muñoz-Granados, Oscar; Andrade-López, Noemí; Alvarado-Rodríguez, José G; Martínez-Otero, Diego Dinuclear zinc(II) acetate complexes derived from N,N',S-tridentate Schiff bases: synthesis, structural study and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 698-706
Space group: P 1 21/c 1
Cell volume: 2964.6
Cell parameters: 11.745; 31.0516; 8.5857; 90; 108.777; 90;

COD ID: 2312661

Formula: - C46 H38 N5 O4 S3 Zn2 -
Comments: Anaya-Avila, Odalys; Muñoz-Granados, Oscar; Andrade-López, Noemí; Alvarado-Rodríguez, José G; Martínez-Otero, Diego Dinuclear zinc(II) acetate complexes derived from N,N',S-tridentate Schiff bases: synthesis, structural study and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 698-706
Space group: P -1
Cell volume: 2129.46
Cell parameters: 10.7102; 13.1376; 17.1385; 100.87; 101.489; 110.186;

COD ID: 2312662

Formula: - C10 H19 N5 O4 -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Hydrogen-bonding interactions in the salts 2,4,6-triaminopyrimidin-1-ium sorbate dihydrate, 2,4,6-triaminopyrimidin-1-ium N-phenylantharanilate and 2,4,6-triaminopyrimidin-1-ium p-toluenesulfonate. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 728-733
Space group: P -1
Cell volume: 673.83
Cell parameters: 8.2507; 8.587; 10.6398; 105.438; 109.18; 94.887;

COD ID: 2312663

Formula: - C17 H18 N6 O2 -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Hydrogen-bonding interactions in the salts 2,4,6-triaminopyrimidin-1-ium sorbate dihydrate, 2,4,6-triaminopyrimidin-1-ium N-phenylantharanilate and 2,4,6-triaminopyrimidin-1-ium p-toluenesulfonate. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 728-733
Space group: I 1 2/a 1
Cell volume: 3160.7
Cell parameters: 13.1498; 12.1582; 20.6224; 90; 106.538; 90;

COD ID: 2312664

Formula: - C11 H15 N5 O3 S -
Comments: Mohana, Marimuthu; Gomathi, Sundaramoorthy; Thomas Muthiah, Packianathan; Butcher, Ray J. Hydrogen-bonding interactions in the salts 2,4,6-triaminopyrimidin-1-ium sorbate dihydrate, 2,4,6-triaminopyrimidin-1-ium N-phenylantharanilate and 2,4,6-triaminopyrimidin-1-ium p-toluenesulfonate. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 728-733
Space group: P -1
Cell volume: 683.5
Cell parameters: 6.8382; 8.3657; 12.5848; 92.727; 104.992; 99.194;

COD ID: 2312666

Formula: - C20 H15 N5 -
Comments: Zhang, Qing; Wang, Zi Quan; Xing, Dian Xiang; Wang, Shou Juan; Tan, Xue Jie Synthesis, crystal structures and antiproliferative activities of a new indole-containing dipyridylmethanone hydrazone Schiff base and its cadmium(II) complex. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 748-760
Space group: P b c 21
Cell volume: 3334.4
Cell parameters: 4.8448; 25.9645; 26.5071; 90; 90; 90;

COD ID: 2312667

Formula: - C20 H15 Cd Cl2 N5 -
Comments: Zhang, Qing; Wang, Zi Quan; Xing, Dian Xiang; Wang, Shou Juan; Tan, Xue Jie Synthesis, crystal structures and antiproliferative activities of a new indole-containing dipyridylmethanone hydrazone Schiff base and its cadmium(II) complex. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 748-760
Space group: R -3 c :H
Cell volume: 19199.9
Cell parameters: 34.6379; 34.6379; 18.4784; 90; 90; 120;

COD ID: 2312668

Formula: - C56 H85 B Ce Cl O8 -
Comments: Thomas, Jarrod R.; Sarma, Kavisha A.; Giansiracusa, Marcus J.; Sulway, Scott A. Structural comparison of [Ce(OtBu)Cl(THF)5](BPh4) to smaller rare earth analogues. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 761-765
Space group: P 1 21/n 1
Cell volume: 5529.2
Cell parameters: 13.6042; 12.5699; 32.334; 90; 90.041; 90;

COD ID: 2312669

Formula: - C56 H85 B Ce Cl O8 -
Comments: Thomas, Jarrod R.; Sarma, Kavisha A.; Giansiracusa, Marcus J.; Sulway, Scott A. Structural comparison of [Ce(OtBu)Cl(THF)5](BPh4) to smaller rare earth analogues. Acta crystallographica. Section C, Structural chemistry 80(Pt 11) (2024) 761-765
Space group: P 1 21/n 1
Cell volume: 5674.2
Cell parameters: 13.7578; 12.5548; 32.8512; 90; 90.336; 90;

COD ID: 2312689

Formula: - Cl16 Se4 -
Comments: Guzmán-Hernández, Juan de Dios; Jancik, Vojtech Bonding properties and crystal packing in β-(SeCl4)4 derived from Hirshfeld Atom Refinement. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: C 1 2/c 1
Cell volume: 2101.83
Cell parameters: 16.31259; 9.79402; 14.76098; 90; 116.969; 90;

COD ID: 2312690

Formula: - C16 H25 Fe3 O17 -
Comments: Abrahams, Brendan F.; Robson, Richard; Commons, Christopher J. A polymeric form of basic iron(III) acetate with an acetic acid ligand. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: P b c a
Cell volume: 4908.22
Cell parameters: 15.8661; 15.864; 19.5003; 90; 90; 90;

COD ID: 2312691

Formula: - C2 H9 As2 F12 N O3 S -
Comments: Bockmair, Valentin; Klöck, Andreas; Hollenwäger, Dirk; Kornath, Andreas J. Diprotonation of taurine: 2-[dihydroxy(oxo)sulfanyliumyl]ethanaminium bis[hexafluoroarsenate(V)]. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: P 21 21 21
Cell volume: 1284.27
Cell parameters: 9.711; 9.7629; 13.5461; 90; 90; 90;

COD ID: 2312692
CIF file Original IUCr paper	Formula: - C2 H Cl2 F6 O2 Sb - Comments: Steiner, Sebastian; Djordjevic, Kristina; Bockmair, Valentin; Hollenwäger, Dirk; Kornath, Andreas J. Protonated oxalyl chloride and the ClCO<sup>+</sup> cation. Acta crystallographica. Section C, Structural chemistry 80(12) (2024) Space group: P 1 21 1 Cell volume: 440.61 Cell parameters: 6.1616; 10.8379; 6.8805; 90; 106.472; 90;

COD ID: 2312693
CIF file Original IUCr paper	Formula: - C Cl F16 O Sb3 - Comments: Steiner, Sebastian; Djordjevic, Kristina; Bockmair, Valentin; Hollenwäger, Dirk; Kornath, Andreas J. Protonated oxalyl chloride and the ClCO<sup>+</sup> cation. Acta crystallographica. Section C, Structural chemistry 80(12) (2024) Space group: P 31 Cell volume: 1037.22 Cell parameters: 8.0824; 8.0824; 18.3341; 90; 90; 120;

COD ID: 2312694

Formula: - C19 H19 N3 O2 -
Comments: Al Mamari, Hamad H.; Al Sulaimi, Shamsaa; Mardiana, Lina; Waddell, Paul G.; Hall, Michael J. High-throughput crystallization and crystal structure of N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-methylbenzamide: a benzamide bearing the 4-aminoantipyrine moiety. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: P 1 21/c 1
Cell volume: 1661.99
Cell parameters: 14.043; 6.013; 20.3113; 90; 104.295; 90;

COD ID: 2312695

Formula: - C30 H49 Fe3 N6 Na3 O37 -
Comments: Kherfi, Hamza; Benhacine, Mohamed Al Amine; Hamadene, Malika A novel layered structure of the heterometallic oxalate compound [NH2(CH3)2]2[NaFe(C2O4)3]·0.33NH(CH3)2·0.33H2O: synthesis, crystal structure and thermal decomposition. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: C 2 2 21
Cell volume: 10270.3
Cell parameters: 12.6024; 17.6259; 46.236; 90; 90; 90;

COD ID: 2312696

Formula: - C44 H28 Cl2 Cu3 N8 O10 -
Comments: Zhao, Xiaoya; Su, Boya; Zhao, Qian; Lv, Wan; Chen, Litong; Huang, Lixin; Li, Xia; Liao, Shengyun Construction of pyridine-functionalized metal-organic frameworks for the detection of flazasulfuron. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: P -1
Cell volume: 1985.7
Cell parameters: 11.2134; 13.8055; 14.5447; 105.621; 112.318; 91.39;

COD ID: 2312697

Formula: - C60 H40 Cu3 N8 O20 -
Comments: Zhao, Xiaoya; Su, Boya; Zhao, Qian; Lv, Wan; Chen, Litong; Huang, Lixin; Li, Xia; Liao, Shengyun Construction of pyridine-functionalized metal-organic frameworks for the detection of flazasulfuron. Acta crystallographica. Section C, Structural chemistry 80(12) (2024)
Space group: P -1
Cell volume: 1428.4
Cell parameters: 10.3591; 11.0086; 13.9603; 89.525; 78.044; 66.947;

COD ID: 2312729