Crystallography Open Database
Search results
Result: there are 198 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Acta crystallographica. Section C, Structural chemistry' volume of publication is 80
COD ID  |
Links | Formula |
Space group  |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2312692 | CIF Paper | C2 H Cl2 F6 O2 Sb | P 1 21 1 | 6.1616; 10.8379; 6.8805 90; 106.472; 90 | 440.61 | 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, 2024, 80 |
| 2312418 | CIF HKL Paper | C29 H21 Br N4 O5 Zn | P 1 21/c 1 | 9.73; 16.52; 17.649 90; 103.19; 90 | 2762 | 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, 2024, 80 |
| 2312458 | CIF HKL Paper | C22 H22 N2 O2 | P 1 21/c 1 | 12.8456; 5.5803; 16.7446 90; 132.566; 90 | 884.01 | Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312460 | CIF HKL Paper | C22 H22 N2 O2 | P 1 21/c 1 | 15.0486; 9.1347; 18.5227 90; 136.112; 90 | 1765.16 | Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312472 | CIF Paper | C68 H56 B3 Ce Cl4 N12 O6 | P 1 21/c 1 | 11.2742; 27.1355; 21.3644 90; 90.166; 90 | 6536 | 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, 2024, 80 |
| 2312477 | CIF HKL Paper | C6 H12 N8 O13 | P 1 21/c 1 | 11.2164; 20.8114; 6.6646 90; 90.435; 90 | 1555.67 | 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, 2024, 80 |
| 2312479 | CIF Paper | C10 H18 Cu3 N6 O2 | P 1 21/c 1 | 9.3903; 8.9608; 9.7986 90; 112.134; 90 | 763.74 | 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, 2024, 80 |
| 2312480 | CIF Paper | C8 H14 Cu3 N6 O2 | P 1 21/c 1 | 9.5158; 8.8022; 9.3589 90; 117.358; 90 | 696.22 | 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, 2024, 80 |
| 2312504 | CIF HKL Paper | C42 H30 Cl2 Mn N6 O8 | P 1 21/c 1 | 9.51026; 12.5149; 31.2962 90; 96.878; 90 | 3698.07 | 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, 2024, 80 |
| 2312505 | CIF HKL Paper | C42 H30 Cl2 N6 Ni O8 | P 1 21/c 1 | 9.3581; 12.6255; 31.4046 90; 97.038; 90 | 3682.52 | 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, 2024, 80 |
| 2312526 | CIF HKL Paper | C13 H13 Cl N2 O3 | P 1 21/c 1 | 11.7399; 8.3731; 13.6779 90; 106.782; 90 | 1287.27 | 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, 2024, 80, 302-310 |
| 2312529 | CIF HKL Paper | C51 H43 F6 N2 O P3 Ru | P 1 21/c 1 | 14.9624; 21.9572; 17.1148 90; 109.266; 90 | 5307.9 | 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, 2024, 80, 319-330 |
| 2312536 | CIF Paper | C26 H22 Mn O2 P S | P 1 21/c 1 | 7.7281; 16.8523; 18.0339 90; 96.696; 90 | 2332.65 | Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>]. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312539 | CIF Paper | C30 H30 Mn O2 P S5 | P 1 21/c 1 | 12.5274; 13.6748; 17.9841 90; 107.934; 90 | 2931.2 | Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>]. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312545 | CIF Paper | C12 H9 N O5 | P 1 21/c 1 | 13.0541; 13.4304; 13.1257 90; 115.354; 90 | 2079.57 | 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, 2024, 80 |
| 2312555 | CIF HKL Paper | C6 H12 N6 O S2 | P 1 21/c 1 | 9.5521; 13.9524; 9.9961 90; 117.12; 90 | 1185.75 | 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, 2024, 80 |
| 2312556 | CIF HKL Paper | C45 H40 N13 S3 | P 1 21/c 1 | 25.5771; 11.7896; 13.6126 90; 92.484; 90 | 4100.9 | 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, 2024, 80 |
| 2312578 | CIF HKL Paper | C20 H20 Br F4 I N4 | P 1 21/c 1 | 7.3898; 16.212; 9.4236 90; 106.304; 90 | 1083.58 | 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, 2024, 80 |
| 2312580 | CIF | C17 H19 Cl F18 O5 Ti | P 1 21/c 1 | 14.05; 10.701; 18.692 90; 108.45; 90 | 2665.9 | Van Der Sluys, William G. Concerning the structures of Lewis base adducts of titanium(IV) hexafluoroisopropoxide. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312584 | CIF HKL Paper | C9 H14 Cu N4 O7 | P 1 21/c 1 | 7.0587; 20.3107; 18.9523 90; 91.77; 90 | 2715.8 | 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, 2024, 80 |
| 2312586 | CIF HKL Paper | C48 H72 Cu3 N24 O29 | P 1 21/c 1 | 7.7912; 12.5972; 32.481 90; 96.802; 90 | 3165.5 | 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, 2024, 80 |
| 2312588 | CIF HKL Paper | C26 H31.6 Cl N4 O4.3 S2 | P 1 21/c 1 | 12.0993; 13.4307; 17.3586 90; 103.667; 90 | 2740.94 | 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, 2024, 80 |
| 2312589 | CIF Paper | C45 H57 N25 Ti2 | P 1 21/c 1 | 11.6292; 22.6611; 22.3631 90; 93.857; 90 | 5880 | 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, 2024, 80 |
| 2312604 | CIF Paper | C26 H14 B F3 N6 O | P 1 21/c 1 | 10.4664; 15.4986; 14.3171 90; 110.221; 90 | 2179.3 | 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, 2024, 80 |
| 2312606 | CIF Paper | C28 H21 B N6 O | P 1 21/c 1 | 14.3815; 8.2702; 19.866 90; 102.074; 90 | 2310.55 | 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, 2024, 80 |
| 2312611 | CIF Paper | C31 H17 B N6 O2 | P 1 21/c 1 | 15.671; 11.192; 15.2363 90; 115.386; 90 | 2414.3 | 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, 2024, 80 |
| 2312612 | CIF Paper | C27 H21 B N6 O Si | P 1 21/c 1 | 16.343; 11.9655; 12.5059 90; 99.996; 90 | 2408.4 | 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, 2024, 80 |
| 2312616 | CIF Paper | C31 H20 B N7 | P 1 21/c 1 | 10.3502; 20.7509; 12.2816 90; 114.734; 90 | 2395.8 | 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, 2024, 80 |
| 2312649 | CIF HKL Paper | C26 H29 N7 O4 | P 1 21/c 1 | 5.6392; 13.4963; 31.968 90; 92.79; 90 | 2430.1 | 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, 2024, 80 |
| 2312660 | CIF HKL Paper | C30 H28 N4 O4 S2 Zn2 | P 1 21/c 1 | 11.745; 31.0516; 8.5857 90; 108.777; 90 | 2964.6 | 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, 2024, 80 |
| 2312694 | CIF HKL Paper | C19 H19 N3 O2 | P 1 21/c 1 | 14.043; 6.013; 20.3113 90; 104.295; 90 | 1661.99 | 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, 2024, 80 |
| 2312568 | CIF Paper | C16 H19 Br0.93 I3.07 N2 O2 | P 1 21/m 1 | 5.8956; 18.6224; 19.9632 90; 91.97; 90 | 2190.47 | Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312574 | CIF HKL Paper | C18 H14 Br2 N6 O Zn | P 1 21/m 1 | 9.9449; 14.1246; 14.3921 90; 93.216; 90 | 2018.44 | 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, 2024, 80 |
| 2023274 | CIF HKL Paper | C11 H10 N4 O5 | P 1 21/n 1 | 3.6374; 11.3412; 26.751 90; 92.162; 90 | 1102.76 | Książkiewicz, Olga A salt from biologically active compounds pyridine-2,3-dicarboxylic (quinolinic) acid and cytosine Acta Crystallographica Section C Structural Chemistry, 2024, 80 |
| 2312365 | CIF HKL Paper | C14 H14 N2 O6 U | P 1 21/n 1 | 7.734; 19.01; 10.6154 90; 96.106; 90 | 1551.9 | 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, 2024, 80 |
| 2312366 | CIF HKL Paper | C34 H36 N6 O15 U3 | P 1 21/n 1 | 13.809; 12.6324; 23.699 90; 103.412; 90 | 4021.3 | 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, 2024, 80 |
| 2312417 | CIF Paper | C6 H12 O6 | P 1 21/n 1 | 6.61708; 12.0474; 18.88721 90; 93.9791; 90 | 1502.03 | 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, 2024, 80, 91-97 |
| 2312468 | CIF Paper | C16 H22 K N3 O7 S | P 1 21/n 1 | 9.4006; 12.1583; 34.4743 90; 95.496; 90 | 3922.14 | 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, 2024, 80, 66-79 |
| 2312520 | CIF Paper | C13 H18 N2 O3 | P 1 21/n 1 | 15.3994; 10.6592; 16.9261 90; 110.424; 90 | 2603.68 | 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, 2024, 80 |
| 2312527 | CIF HKL Paper | C49 H39 F6 N2 O P3 Ru | P 1 21/n 1 | 10.5442; 21.1741; 21.9326 90; 97.528; 90 | 4854.6 | 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, 2024, 80, 319-330 |
| 2312531 | CIF Paper | C19 H40 Cl2 I9 N2 O6 | P 1 21/n 1 | 13.831; 14.82; 20.266 90; 96.7; 90 | 4125.7 | 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, 2024, 80, 311-318 |
| 2312538 | CIF Paper | C28 H25 Br Mn O2 P S3 | P 1 21/n 1 | 8.7717; 13.2135; 23.9428 90; 92.884; 90 | 2771.6 | Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>]. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312547 | CIF HKL Paper | C66 H106 Er N5 O17.5 S3 | P 1 21/n 1 | 15.3967; 30.6741; 16.0612 90; 90.172; 90 | 7585.35 | 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, 2024, 80 |
| 2312559 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.11; 11.81; 5.44 90; 113.1; 90 | 302 | 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, 2024, 80, 264-277 |
| 2312560 | CIF Paper | C2 H5 N O2 | P 1 21/n 1 | 5.11; 11.81; 5.44 90; 113.1; 90 | 302 | 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, 2024, 80, 264-277 |
| 2312564 | CIF Paper | C16 H19 Cl N2 O2 | P 1 21/n 1 | 7.7936; 18.3639; 16.3922 90; 102.245; 90 | 2292.69 | Jaconelli, Harry S.; Kennedy, Alan R. Salt forms of amides: protonation of acetanilide. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312581 | CIF HKL Paper | C15 H3 F18 Fe O6 | P 1 21/n 1 | 8.7659; 12.9796; 19.1759 90; 91.632; 90 | 2180.91 | 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, 2024, 80 |
| 2312591 | CIF Paper | C65.75 H70 N36 O Ta2 | P 1 21/n 1 | 22.5131; 25.5101; 26.7165 90; 101.383; 90 | 15041.8 | 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, 2024, 80 |
| 2312598 | CIF HKL Paper | C14 H12 N2 O11 Zn | P 1 21/n 1 | 10.768; 5.0511; 29.334 90; 94.409; 90 | 1590.8 | 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, 2024, 80 |
| 2312602 | CIF Paper | C26 H17 B N6 O | P 1 21/n 1 | 9.0313; 14.22; 16.474 90; 102.667; 90 | 2064.2 | 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, 2024, 80 |
| 2312603 | CIF Paper | C26 H17 B N6 O | P 1 21/n 1 | 9.0304; 14.2423; 16.4452 90; 102.476; 90 | 2065.1 | 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, 2024, 80 |
| 2312668 | CIF HKL Paper | C56 H85 B Ce Cl O8 | P 1 21/n 1 | 13.6042; 12.5699; 32.334 90; 90.041; 90 | 5529.2 | Thomas, Jarrod R.; Sarma, Kavisha A.; Giansiracusa, Marcus J.; Sulway, Scott A. Structural comparison of [Ce(O<sup>t</sup>Bu)Cl(THF)<sub>5</sub>](BPh<sub>4</sub>) to smaller rare earth analogues. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312669 | CIF HKL Paper | C56 H85 B Ce Cl O8 | P 1 21/n 1 | 13.7578; 12.5548; 32.8512 90; 90.336; 90 | 5674.2 | Thomas, Jarrod R.; Sarma, Kavisha A.; Giansiracusa, Marcus J.; Sulway, Scott A. Structural comparison of [Ce(O<sup>t</sup>Bu)Cl(THF)<sub>5</sub>](BPh<sub>4</sub>) to smaller rare earth analogues. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312519 | CIF Paper | C70 H120 Cu2 N4 O30 | P 1 c 1 | 9.7404; 20.3001; 22.9088 90; 118.494; 90 | 3981.1 | 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, 2024, 80 |
| 2022997 | CIF HKL Paper | C15 H17 Br N2 S | P 21 21 21 | 7.9846; 9.1982; 19.3636 90; 90; 90 | 1422.14 | 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, 2024, 80, 15-20 |
| 2023210 | CIF HKL Paper | C17 H22 N6 O2 | P 21 21 21 | 9.9563; 15.1596; 23.6491 90; 90; 90 | 3569.4 | 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, 2024, 80 |
| 2023211 | CIF HKL Paper | C17 H21 N6 O4 P | P 21 21 21 | 7.1398; 12.0894; 43.818 90; 90; 90 | 3782.2 | 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, 2024, 80 |
| 2312397 | CIF Paper | C58 H52 N4 O8 | P 21 21 21 | 33.5486; 26.4223; 5.36515 90; 90; 90 | 4755.84 | 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, 2024, 80, 37-42 |
| 2312470 | CIF Paper | C13 H14 O5 | P 21 21 21 | 4.9524; 11.0302; 20.9007 90; 90; 90 | 1141.72 | 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, 2024, 80 |
| 2312550 | CIF Paper | C29 H40 O9 | P 21 21 21 | 9.2707; 15.2236; 20.0806 90; 90; 90 | 2834 | 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, 2024, 80 |
| 2312551 | CIF Paper | C29 H40 O9 | P 21 21 21 | 9.302; 15.412; 20.191 90; 90; 90 | 2894.6 | 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, 2024, 80 |
| 2312557 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.89; 5.99; 12.22 90; 90; 90 | 431 | 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, 2024, 80, 264-277 |
| 2312558 | CIF Paper | C3 H7 N O2 | P 21 21 21 | 5.89; 5.99; 12.22 90; 90; 90 | 431 | 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, 2024, 80, 264-277 |
| 2312617 | CIF Paper | C4 H12 Ca O10 | P 21 21 21 | 9.1587; 9.5551; 10.5041 90; 90; 90 | 919.24 | 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, 2024, 80 |
| 2312618 | CIF HKL Paper | C24 H35 N2 O6.5 | P 21 21 21 | 8.1508; 11.0066; 25.7084 90; 90; 90 | 2306.37 | 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, 2024, 80 |
| 2312619 | CIF HKL Paper | C22 H32 N2 O5 | P 21 21 21 | 9.2999; 12.7329; 17.5349 90; 90; 90 | 2076.39 | 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, 2024, 80 |
| 2312691 | CIF Paper | C2 H9 As2 F12 N O3 S | P 21 21 21 | 9.711; 9.7629; 13.5461 90; 90; 90 | 1284.27 | 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, 2024, 80 |
| 2312693 | CIF Paper | C Cl F16 O Sb3 | P 31 | 8.0824; 8.0824; 18.3341 90; 90; 120 | 1037.22 | 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, 2024, 80 |
| 2312483 | CIF Paper | C12 H16 N2 O4 | P 41 21 2 | 11.1312; 11.1312; 10.894 90; 90; 90 | 1349.8 | 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, 2024, 80 |
| 2312620 | CIF HKL Paper | C15 H27.5 N2 O2.75 | P 43 21 2 | 11.7364; 11.7364; 21.9295 90; 90; 90 | 3020.64 | 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, 2024, 80 |
| 2312666 | CIF HKL Paper | C20 H15 N5 | P b c 21 | 4.8448; 25.9645; 26.5071 90; 90; 90 | 3334.4 | 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, 2024, 80 |
| 2023076 | CIF Paper | C18 H19 Br N2 O3 S | P b c a | 12.407; 17.425; 17.5276 90; 90; 90 | 3789.3 | 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, 2024, 80, 129-142 |
| 2312420 | CIF HKL Paper | C17 H12 N6 | P b c a | 8.5626; 18.701; 19.024 90; 90; 90 | 3046.3 | 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, 2024, 80 |
| 2312424 | CIF HKL Paper | C18 H14 N6 | P b c a | 15.7069; 11.8266; 17.5763 90; 90; 90 | 3265 | 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, 2024, 80 |
| 2312476 | CIF HKL Paper | C6 H10 N8 O12 | P b c a | 21.4196; 6.1927; 21.9265 90; 90; 90 | 2908.44 | 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, 2024, 80 |
| 2312517 | CIF Paper | C56 H52 Cu2 N4 O20 | P b c a | 17.5993; 16.4583; 19.7389 90; 90; 90 | 5717.46 | 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, 2024, 80 |
| 2312524 | CIF Paper | C3 H8 N2 O4 | P b c a | 9.9714; 9.8671; 11.1884 90; 90; 90 | 1100.81 | 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, 2024, 80, 291-296 |
| 2312537 | CIF Paper | C27 H23 Br Mn O2 P S2 | P b c a | 16.5563; 16.2392; 19.3372 90; 90; 90 | 5199 | Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>]. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312541 | CIF HKL Paper | C25 H21 Cl N2 O4 S | P b c a | 10.792; 18.713; 23.299 90; 90; 90 | 4705.25 | 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, 2024, 80 |
| 2312542 | CIF HKL Paper | C25 H20 Cl F N2 O4 S | P b c a | 10.536; 19.246; 23.343 90; 90; 90 | 4733.4 | 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, 2024, 80 |
| 2312605 | CIF Paper | C28 H21 B N6 O | P b c a | 14.6398; 15.2842; 20.5313 90; 90; 90 | 4594 | 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, 2024, 80 |
| 2312690 | CIF HKL Paper | C16 H25 Fe3 O17 | P b c a | 15.8661; 15.864; 19.5003 90; 90; 90 | 4908.22 | 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, 2024, 80 |
| 2312548 | CIF HKL Paper | C27 H22 Br2 Co N3 O2 S3 | P c a 21 | 16.5337; 13.2578; 13.4575 90; 90; 90 | 2949.9 | 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, 2024, 80 |
| 2312549 | CIF Paper | F7 Ge H2 Na | P c a 21 | 12.3786; 7.2189; 11.4969 90; 90; 90 | 1027.36 | 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, 2024, 80 |
| 2312465 | CIF Paper | C12 H13 N3 O4 S | P c c n | 12.6592; 28.3597; 7.1268 90; 90; 90 | 2558.6 | 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, 2024, 80, 66-79 |
| 2312469 | CIF Paper | C12 H9 K N2 O4 S | P c c n | 12.5535; 27.9698; 6.9982 90; 90; 90 | 2457.2 | 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, 2024, 80, 66-79 |
| 2312509 | CIF Paper | C52 H68 Cu2 O24 | P c c n | 27.7701; 21.2278; 9.3888 90; 90; 90 | 5534.7 | 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, 2024, 80 |
| 2312657 | CIF Paper | C22 H18 Fe S2 | P m n 21 | 14.0977; 7.1607; 8.8504 90; 90; 90 | 893.44 | Blockhaus, Tobias; Sünkel, Karlheinz Molecular and crystal structures of six poly(arylsulfinyl)- and poly(arylsulfanyl)ferrocenes. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
| 2312513 | CIF Paper | C85 H108 Cu4 N2 O32 | P n m a | 12.833; 54.548; 12.119 90; 90; 90 | 8483 | 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, 2024, 80 |
| 2312553 | CIF HKL Paper | C14 H10 Br N3 | P n m a | 8.7734; 7.0554; 19.7544 90; 90; 90 | 1222.79 | 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, 2024, 80 |
| 2312573 | CIF HKL Paper | C18 H14 Br2 N6 O Zn | P n m a | 14.4614; 14.1299; 10.1503 90; 90; 90 | 2074.09 | 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, 2024, 80 |
| 2312575 | CIF HKL Paper | C18 H14 Cl2 N6 O Zn | P n m a | 14.1507; 14.0162; 9.8624 90; 90; 90 | 1956.1 | 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, 2024, 80 |
| 2312599 | CIF Paper | C24 H12 B Cl N6 | P n m a | 12.0315; 14.8174; 10.3002 90; 90; 90 | 1836.3 | 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, 2024, 80 |
| 2312600 | CIF Paper | C24 H12 B Br N6 | P n m a | 12.001; 15.0617; 10.3879 90; 90; 90 | 1877.67 | 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, 2024, 80 |
| 2312601 | CIF Paper | C25 H15 B N6 O | P n m a | 12.3162; 15.2325; 10.4151 90; 90; 90 | 1953.9 | 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, 2024, 80 |
| 2312609 | CIF Paper | C34 H19 B N6 O | P n m a | 17.133; 13.929; 10.3669 90; 90; 90 | 2474 | 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, 2024, 80 |
| 2023017 | CIF Paper | C66 H44 Cu3 Eu2 N18 O31 | R -3 c :H | 14.0021; 14.0021; 63.523 90; 90; 120 | 10785.7 | 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, 2024, 80, 49-55 |
| 2312667 | CIF HKL Paper | C20 H15 Cd Cl2 N5 | R -3 c :H | 34.6379; 34.6379; 18.4784 90; 90; 120 | 19199.9 | 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, 2024, 80 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!