Crystallography Open Database
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Searching journal of publication like 'Acta Crystallographica Section C Crystal Structure Communications'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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2022256 | CIF HKL Paper | C24 H48 Mg N6 O26 S4 | C 1 2/c 1 | 36.896; 6.7806; 17.914 90; 111.178; 90 | 4179 | Gardner, Heather C.; Kennedy, Alan R.; McCarney, Karen M.; Staunton, Edward; Stewart, Heather; Teat, Simon J. Structures of five salt forms of disulfonated monoazo dyes Acta Crystallographica Section C, 2020, 76, 972-981 |
2022257 | CIF HKL Paper | C14 H25 Ba N3 O13 S2 | P b c a | 7.1293; 18.8368; 34.752 90; 90; 90 | 4667 | Gardner, Heather C.; Kennedy, Alan R.; McCarney, Karen M.; Staunton, Edward; Stewart, Heather; Teat, Simon J. Structures of five salt forms of disulfonated monoazo dyes Acta Crystallographica Section C, 2020, 76, 972-981 |
2022258 | CIF HKL Paper | C8 H10 N8 S2 | C 1 c 1 | 12.3766; 10.7745; 9.205 90; 104.777; 90 | 1186.9 | Grześkiewicz, Anita M.; Ostrowska, Agata; Borzylo, Dmytro; Kubicki, Maciej When solvent becomes reactant: a study of 6-aminothiocytosine derivatives Acta Crystallographica Section C, 2020, 76, 992-999 |
2022259 | CIF HKL Paper | C9 H12 N8 S2 | F d d 2 | 36.9868; 15.5842; 4.2131 90; 90; 90 | 2428.47 | Grześkiewicz, Anita M.; Ostrowska, Agata; Borzylo, Dmytro; Kubicki, Maciej When solvent becomes reactant: a study of 6-aminothiocytosine derivatives Acta Crystallographica Section C, 2020, 76, 992-999 |
2022260 | CIF HKL Paper | C6 H10 N4 O S | P 1 21/c 1 | 8.6783; 9.1691; 11.4391 90; 97.846; 90 | 901.71 | Grześkiewicz, Anita M.; Ostrowska, Agata; Borzylo, Dmytro; Kubicki, Maciej When solvent becomes reactant: a study of 6-aminothiocytosine derivatives Acta Crystallographica Section C, 2020, 76, 992-999 |
2022261 | CIF HKL Paper | C4 H5 K N4 O2 S | P -1 | 6.9631; 8.035; 8.0886 103.021; 111.568; 106.007 | 376.56 | Grześkiewicz, Anita M.; Ostrowska, Agata; Borzylo, Dmytro; Kubicki, Maciej When solvent becomes reactant: a study of 6-aminothiocytosine derivatives Acta Crystallographica Section C, 2020, 76, 992-999 |
2022262 | CIF HKL Paper | C13 H10.5 Cl2 N3.5 O2 Pt | C 2 2 21 | 7.4469; 27.9271; 14.3092 90; 90; 90 | 2975.89 | Khalaj, Mehdi; Olyaei, Abolfazl; Sadeghpour, Mahdieh; Lalegani, Arash; Lipkowski, Janusz; Lough, Alan J. Platinum(II) complex with 4-nitro-<i>N</i>-(pyridin-2-ylmethylidene)aniline: synthesis, characterization, crystal structure and antioxidant activity Acta Crystallographica Section C, 2020, 76 |
2022263 | CIF HKL Paper | C25 H36 Cd N4 O8 | P 1 21/c 1 | 9.0047; 16.5608; 19.4709 90; 107.493; 90 | 2769.3 | Zhao, Fang-Hua; Li, Shi-Yao; Guo, Wen-Yu; Zhao, Zi-Hao; Guo, Xiao-Wen; Li, Yu-Shuo; Fan, Sheng-Qing; Li, Zhong-Lin Two new Cd^II^ MOFs of 1,4-bis(1<i>H</i>-benzimidazol-1-yl)butane and flexible dicarboxylate ligands: luminescence sensing towards Fe^3+^ Acta Crystallographica Section C, 2020, 76 |
2022264 | CIF HKL Paper | C19 H27 Cd N2 O5 | P -1 | 8.2423; 10.6568; 12.4175 105.466; 92.7; 103.416 | 1015.6 | Zhao, Fang-Hua; Li, Shi-Yao; Guo, Wen-Yu; Zhao, Zi-Hao; Guo, Xiao-Wen; Li, Yu-Shuo; Fan, Sheng-Qing; Li, Zhong-Lin Two new Cd^II^ MOFs of 1,4-bis(1<i>H</i>-benzimidazol-1-yl)butane and flexible dicarboxylate ligands: luminescence sensing towards Fe^3+^ Acta Crystallographica Section C, 2020, 76 |
2022265 | CIF HKL Paper | C32 H31 Br N2 O2 | P 21 21 21 | 11.1584; 13.6425; 36.061 90; 90; 90 | 5489.5 | Okezue, Mercy; Smith, Daniel; Zeller, Matthias; Byrn, Stephen R.; Smith, Pamela; Bogandowich-Knipp, Susan; Purcell, Dale K.; Clase, Kari L. Crystal structures of salts of bedaquiline Acta Crystallographica Section C, 2020, 76 |
2022266 | CIF HKL Paper | C36 H35 Br N2 O6 | P 1 21 1 | 16.4556; 10.3205; 20.1636 90; 109.183; 90 | 3234.2 | Okezue, Mercy; Smith, Daniel; Zeller, Matthias; Byrn, Stephen R.; Smith, Pamela; Bogandowich-Knipp, Susan; Purcell, Dale K.; Clase, Kari L. Crystal structures of salts of bedaquiline Acta Crystallographica Section C, 2020, 76 |
2022267 | CIF HKL Paper | C17 H14 Br N O | P 21 21 21 | 4.3606; 10.82; 29.886 90; 90; 90 | 1410.1 | Okezue, Mercy; Smith, Daniel; Zeller, Matthias; Byrn, Stephen R.; Smith, Pamela; Bogandowich-Knipp, Susan; Purcell, Dale K.; Clase, Kari L. Crystal structures of salts of bedaquiline Acta Crystallographica Section C, 2020, 76 |
2022268 | CIF HKL Paper | C39 H39.34 Br N2 O5.17 | P 1 21 1 | 12.6384; 7.9259; 17.5249 90; 99.845; 90 | 1729.63 | Okezue, Mercy; Smith, Daniel; Zeller, Matthias; Byrn, Stephen R.; Smith, Pamela; Bogandowich-Knipp, Susan; Purcell, Dale K.; Clase, Kari L. Crystal structures of salts of bedaquiline Acta Crystallographica Section C, 2020, 76 |
2022269 | CIF HKL Paper | C40.48 H41.23 Br N2.74 O5 | P 1 21 1 | 12.8661; 8.0386; 17.4704 90; 101.093; 90 | 1773.12 | Okezue, Mercy; Smith, Daniel; Zeller, Matthias; Byrn, Stephen R.; Smith, Pamela; Bogandowich-Knipp, Susan; Purcell, Dale K.; Clase, Kari L. Crystal structures of salts of bedaquiline Acta Crystallographica Section C, 2020, 76 |
2022270 | CIF HKL Paper | C19 H17 Cl2 N O2 | P 1 21 1 | 3.96521; 16.7005; 12.4252 90; 91.185; 90 | 822.63 | Alsafi, Mona A.; Hughes, David L.; Said, Musa A. First COVID-19 molecular docking with a chalcone-based compound: synthesis, single-crystal structure and Hirshfeld surface analysis study Acta Crystallographica Section C Structural Chemistry, 2020, 76 |
2022271 | CIF HKL Paper | C28 H32 Ca3 N4 O29 | P -1 | 6.9363; 15.9791; 16.9786 90.844; 93.106; 98.296 | 1858.93 | Lumpe, Henning; Mayer, Peter; Daumann, Lena J. Crystal structure of a calcium(II)‒pyrroloquinoline quinone (PQQ) complex outside a protein environment Acta Crystallographica Section C, 2020, 76 |
2022272 | CIF HKL Paper | C8 H20 Cl3 Mo O3 | P 21 21 21 | 8.6186; 12.25; 13.5681 90; 90; 90 | 1432.5 | Shaw, Thomas E.; LeMagueres, Pierre; Sattelberger, Alfred P.; Jurca, Titel Crystal structure and Hirshfeld surface analysis of the elusive trichlorobis(diethyl ether)oxomolybdenum(V) Acta Crystallographica Section C, 2020, 76, 947-951 |
2022273 | CIF HKL Paper | C20 H30 N4 O8 | P 1 21/c 1 | 11.071; 18.892; 13.115 90; 123.29; 90 | 2292.9 | Gessmann, Renate; Brückner, Hans; Petratos, Kyriacos Removing the C-terminal protecting group enlarges the crystal size: Z‒(Gly‒Aib)~2~‒OH·H~2~O Acta Crystallographica Section C, 2020, 76 |
2022274 | CIF HKL Paper | C48 H42 Mo6 N4 O32 | P n n m | 19.3159; 15.0183; 19.6537 90; 90; 90 | 5701.4 | Chen, Wen-Tong Crystal structure and photophysical properties of a novel polyoxomolybdate porphyrin Acta Crystallographica Section C, 2020, 76 |
2022275 | CIF HKL Paper | C22 H16 N3 O4.5 Zn | P 1 21/n 1 | 11.0556; 9.5218; 18.2923 90; 100.732; 90 | 1891.9 | Zuo, Yuxiang; Yang, Jie; Chen, Cheng; Xue, Yun-Shan; Zhang, Jun Assembly of two novel coordination polymers by selecting ditopic or chelating auxiliary ligands with naphthalene-2,6-dicarboxylic acid: synthesis, structure and luminescence sensing Acta Crystallographica Section C, 2020, 76 |
2022276 | CIF HKL Paper | C30 H22 Cu N2 O6 | P -1 | 11.0642; 11.1234; 11.6697 61.912; 86.182; 80.602 | 1249.97 | Zuo, Yuxiang; Yang, Jie; Chen, Cheng; Xue, Yun-Shan; Zhang, Jun Assembly of two novel coordination polymers by selecting ditopic or chelating auxiliary ligands with naphthalene-2,6-dicarboxylic acid: synthesis, structure and luminescence sensing Acta Crystallographica Section C, 2020, 76 |
2022277 | CIF HKL Paper | C66 H56 O10 | P -1 | 13.574; 13.829; 14.657 79.013; 87.544; 83.381 | 2682.3 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022278 | CIF HKL Paper | C30 H32 O10 | P 1 21/n 1 | 12.147; 20.697; 12.702 90; 117.432; 90 | 2834 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022279 | CIF HKL Paper | C24 H14 F6 O4 | C 1 2/c 1 | 30.399; 9.176; 14.994 90; 97.204; 90 | 4149 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022280 | CIF HKL Paper | C38 H32 O6 | P -1 | 10.239; 13.056; 23.923 86.992; 89.198; 73.621 | 3064 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022281 | CIF HKL Paper | C26 H24 O6 | P 1 21/n 1 | 9.033; 6.427; 37.08 90; 91.948; 90 | 2151.4 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022282 | CIF HKL Paper | C24 H14 F6 O4 | I 1 2/a 1 | 23.308; 7.132; 27.253 90; 112.62; 90 | 4182 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
2022283 | CIF HKL Paper | C27 H24 N2 O9 | P 1 21 1 | 13.5302; 4.6101; 19.3371 90; 103.603; 90 | 1172.33 | Ye, Wenkang; She, Weiyi; Sung, Herman H.-Y.; Qian, Peiyuan; Williams, Ian D. Albofungin and chloroalbofungin: antibiotic crystals with 2D but not 3D isostructurality Acta Crystallographica Section C, 2020, 76, 1100-1107 |
2022284 | CIF HKL Paper | C27 H23 Cl N2 O9 | C 1 2 1 | 40.6637; 4.52749; 12.7049 90; 98.027; 90 | 2316.11 | Ye, Wenkang; She, Weiyi; Sung, Herman H.-Y.; Qian, Peiyuan; Williams, Ian D. Albofungin and chloroalbofungin: antibiotic crystals with 2D but not 3D isostructurality Acta Crystallographica Section C, 2020, 76, 1100-1107 |
2022285 | CIF HKL Paper | C8 H18 F2 I4 N2 Pb | P 1 21/c 1 | 13.6842; 8.5302; 8.9518 90; 107.996; 90 | 993.81 | Huang, Chao-Ran; Li, Peng-Fei; Luo, Xu-Zhong A two-dimensional organic‒inorganic lead iodide perovskite: poly[bis(3-fluorocyclobutylammonium) [di-μ-iodido-diiodidoplumbate(VI)]] Acta Crystallographica Section C, 2020, 76, 1096-1099 |
2022286 | CIF HKL Paper | C14 H11 I N2 O S | P -1 | 6.241; 7.242; 16.709 84.408; 89.142; 65.933 | 686.02 | Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław The influence of the type of halogen substituent and its position on the molecular conformation, intermolecular interactions and crystal packing for a series of 1-benzoyl-3-(halogenophenyl)thioureas Acta Crystallographica Section C, 2021, 77, 11-19 |
2022287 | CIF HKL Paper | C14 H11 I N2 O S | P 1 c 1 | 4.5639; 15.375; 19.355 90; 91.404; 90 | 1357.7 | Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław The influence of the type of halogen substituent and its position on the molecular conformation, intermolecular interactions and crystal packing for a series of 1-benzoyl-3-(halogenophenyl)thioureas Acta Crystallographica Section C, 2021, 77, 11-19 |
2022288 | CIF HKL Paper | C14 H11 I N2 O S | P -1 | 4.4279; 13.0767; 13.441 61.622; 86.203; 85.241 | 682.06 | Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław The influence of the type of halogen substituent and its position on the molecular conformation, intermolecular interactions and crystal packing for a series of 1-benzoyl-3-(halogenophenyl)thioureas Acta Crystallographica Section C, 2021, 77, 11-19 |
2022289 | CIF HKL Paper | C14 H11 Br N2 O S | P 1 21/n 1 | 3.9592; 15.142; 22.25 90; 95.183; 90 | 1328.4 | Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław The influence of the type of halogen substituent and its position on the molecular conformation, intermolecular interactions and crystal packing for a series of 1-benzoyl-3-(halogenophenyl)thioureas Acta Crystallographica Section C, 2021, 77, 11-19 |
2022290 | CIF HKL Paper | C14 H11 Br N2 O S | P 1 c 1 | 4.6404; 15.017; 19.074 90; 91.052; 90 | 1328.9 | Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław The influence of the type of halogen substituent and its position on the molecular conformation, intermolecular interactions and crystal packing for a series of 1-benzoyl-3-(halogenophenyl)thioureas Acta Crystallographica Section C, 2021, 77, 11-19 |
2022291 | CIF HKL Paper | Li2 Pb S4 Si | I -4 2 m | 6.4618; 6.4618; 7.7333 90; 90; 90 | 322.903 | Stoyko, Stanislav S.; Craig, Andrew J.; Kotchey, Joshua W.; Aitken, Jennifer A. Synthesis, crystal structure, and electronic structure of Li~2~PbSiS~4~: a quaternary thiosilicate with a compressed chalcopyrite-like structure Acta Crystallographica Section C, 2021, 77, 1-10 |
2022292 | CIF HKL Paper | C12 H11 N5 O | P 1 21/c 1 | 4.4041; 27.8787; 9.3533 90; 100.816; 90 | 1128 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Svitlana S.; Nikolaeva, Lyudmila L.; Bunyatyan, Natalya D.; Kovalenko, Sergiy M. Conformational polymorphs of 3-cyclopropyl-5-(3-methyl-[1,2,4]triazolo[4,3-<i>a</i>]pyridin-7-yl)-1,2,4-oxadiazole Acta Crystallographica Section C, 2021, 77, 20-28 |
2022293 | CIF HKL Paper | C12 H11 N5 O | P b c a | 12.2191; 8.1593; 22.788 90; 90; 90 | 2271.9 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Svitlana S.; Nikolaeva, Lyudmila L.; Bunyatyan, Natalya D.; Kovalenko, Sergiy M. Conformational polymorphs of 3-cyclopropyl-5-(3-methyl-[1,2,4]triazolo[4,3-<i>a</i>]pyridin-7-yl)-1,2,4-oxadiazole Acta Crystallographica Section C, 2021, 77, 20-28 |
2022295 | CIF HKL Paper | C13 H10 Br N O | P c a 21 | 12.2768; 4.4829; 19.6694 90; 90; 90 | 1082.52 | Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. (<i>E</i>)-4-Bromo-2-[(phenylimino)methyl]phenol: a new polymorph and thermochromism Acta Crystallographica Section C, 2020, 76, 1001-1004 |
2022296 | CIF HKL Paper | C13 H10 Br N O | C 1 c 1 | 25.8944; 6.9439; 6.1499 90; 91.381; 90 | 1105.48 | Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. (<i>E</i>)-4-Bromo-2-[(phenylimino)methyl]phenol: a new polymorph and thermochromism Acta Crystallographica Section C, 2020, 76, 1001-1004 |
2022297 | CIF HKL Paper | C11 H10 N2 O2 S | P 21 21 21 | 3.9876; 10.6511; 25.107 90; 90; 90 | 1066.4 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Kravchenko, Dmitriy V.; Bunyatyan, Natalya D. Polymorphism of methyl 4-amino-3-phenylisothiazole-5-carboxylate: an experimental and theoretical study Acta Crystallographica Section C, 2021, 77, 40-48 |
2022298 | CIF HKL Paper | C11 H10 N2 O2 S | P b c a | 6.921; 7.2371; 42.396 90; 90; 90 | 2123.5 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Kravchenko, Dmitriy V.; Bunyatyan, Natalya D. Polymorphism of methyl 4-amino-3-phenylisothiazole-5-carboxylate: an experimental and theoretical study Acta Crystallographica Section C, 2021, 77, 40-48 |
2022299 | CIF HKL Paper | C14 H14 N2 O3 | C 1 2/c 1 | 43.803; 4.6835; 12.2643 90; 96.105; 90 | 2501.8 | Sugiyama, Haruki; Uekusa, Hidehiro Two-step crystal‒crystal phase transformation of <i>N</i>-salicylidene-<i>p</i>-aminobenzoic acid by gas‒solid reaction with aqua‒ammonia vapour Acta Crystallographica Section C, 2021, 77, 56-60 |
2022300 | CIF HKL Paper | C16 H14 N8 S6 | C 1 2/c 1 | 12.3039; 6.4431; 25.9547 90; 94.145; 90 | 2052.18 | Wzgarda-Raj, Kinga; Rybarczyk-Pirek, Agnieszka Justyna; Wojtulewski, Sławomir; Palusiak, Marcin Trithiocyanuric acid: novel cocrystals and analysis of its tautomeric forms Acta Crystallographica Section C, 2021, 77, 49-55 |
2022301 | CIF HKL Paper | C11 H13 N5 O S3 | P 1 21/c 1 | 24.5777; 8.9406; 13.3772 90; 93.313; 90 | 2934.59 | Wzgarda-Raj, Kinga; Rybarczyk-Pirek, Agnieszka Justyna; Wojtulewski, Sławomir; Palusiak, Marcin Trithiocyanuric acid: novel cocrystals and analysis of its tautomeric forms Acta Crystallographica Section C, 2021, 77, 49-55 |
2022302 | CIF HKL Paper | C12 H10 N6 | P 1 21/c 1 | 13.7529; 6.6451; 12.2086 90; 93.634; 90 | 1113.49 | Niu, Xiang-Long; Wei, Lin; Liu, Jian-Cheng; Jia, Wan-He; Ma, Jian-Ping; Wang, Lei; Wang, Jian-Cheng; Dong, Yu-Bin Syntheses and structures of three macrocyclic supramolecular complexes and one Zn^II^-containing coordination polymer generated from a semi-rigid multidentate N-containing ligand Acta Crystallographica Section C, 2021, 77, 29-39 |
2022303 | CIF HKL Paper | C26 H24 Cl8 N12 Zn2 | C 1 2/c 1 | 30.503; 8.8791; 15.4063 90; 116.856; 90 | 3722.6 | Niu, Xiang-Long; Wei, Lin; Liu, Jian-Cheng; Jia, Wan-He; Ma, Jian-Ping; Wang, Lei; Wang, Jian-Cheng; Dong, Yu-Bin Syntheses and structures of three macrocyclic supramolecular complexes and one Zn^II^-containing coordination polymer generated from a semi-rigid multidentate N-containing ligand Acta Crystallographica Section C, 2021, 77, 29-39 |
2022304 | CIF HKL Paper | C50 H42 Cl14 N24 Zn4 | P 1 21/n 1 | 13.414; 18.504; 14.674 90; 105.834; 90 | 3504 | Niu, Xiang-Long; Wei, Lin; Liu, Jian-Cheng; Jia, Wan-He; Ma, Jian-Ping; Wang, Lei; Wang, Jian-Cheng; Dong, Yu-Bin Syntheses and structures of three macrocyclic supramolecular complexes and one Zn^II^-containing coordination polymer generated from a semi-rigid multidentate N-containing ligand Acta Crystallographica Section C, 2021, 77, 29-39 |
2022305 | CIF HKL Paper | C26 H24 Cl4 I4 N12 Zn2 | C 1 2/c 1 | 30.312; 9.461; 15.434 90; 114.625; 90 | 4024 | Niu, Xiang-Long; Wei, Lin; Liu, Jian-Cheng; Jia, Wan-He; Ma, Jian-Ping; Wang, Lei; Wang, Jian-Cheng; Dong, Yu-Bin Syntheses and structures of three macrocyclic supramolecular complexes and one Zn^II^-containing coordination polymer generated from a semi-rigid multidentate N-containing ligand Acta Crystallographica Section C, 2021, 77, 29-39 |
2022306 | CIF HKL Paper | C13 H11 Cl3 I2 N6 Zn | P -1 | 9.804; 11.35; 11.35 69.43; 65.912; 65.912 | 1026 | Niu, Xiang-Long; Wei, Lin; Liu, Jian-Cheng; Jia, Wan-He; Ma, Jian-Ping; Wang, Lei; Wang, Jian-Cheng; Dong, Yu-Bin Syntheses and structures of three macrocyclic supramolecular complexes and one Zn^II^-containing coordination polymer generated from a semi-rigid multidentate N-containing ligand Acta Crystallographica Section C, 2021, 77, 29-39 |
2022307 | CIF HKL Paper | C70 H70 Cl4 Cu4 I4 N2 O2 P4 | P -1 | 11.95; 12.443; 13.06 83.43; 86.3; 83.76 | 1915.1 | Cao, Bing-Jun; Li, Ran; Huang, Xi-He Synthesis, structure and photophysical properties of two tetranuclear copper(I) iodide complexes based on acetylpyridine and diphosphine mixed ligands Acta Crystallographica Section C, 2021, 77, 61-67 |
2022308 | CIF HKL Paper | C68 H66 Cu4 I4 N2 O2 P4 | P -1 | 11.981; 12.996; 13.23 62.49; 68.32; 83.71 | 1693.1 | Cao, Bing-Jun; Li, Ran; Huang, Xi-He Synthesis, structure and photophysical properties of two tetranuclear copper(I) iodide complexes based on acetylpyridine and diphosphine mixed ligands Acta Crystallographica Section C, 2021, 77, 61-67 |
2022309 | CIF HKL Paper | C14 H38 Cl4 N2 Sn | P 1 21/n 1 | 10.9199; 13.1459; 17.8167 90; 107.328; 90 | 2441.54 | Sabbaghi, Fahimeh; As'habi, Azam; Saneei, Anahid; Pourayoubi, Mehrdad; Abdul Salam, Abdul Ajees; Nečas, Marek; Dušek, Michal; Kučeráková, Monika; Acharya, Sudarshan Conformational analysis of two new organotin(IV) structures completed with a CSD survey Acta Crystallographica Section C, 2021, 77, 68-80 |
2022310 | CIF Paper | C44 H48 Cl8 N6 O2 P2 Sn | P 1 21/n 1 | 15.4589; 8.1983; 20.6655 90; 106.556; 90 | 2510.49 | Sabbaghi, Fahimeh; As'habi, Azam; Saneei, Anahid; Pourayoubi, Mehrdad; Abdul Salam, Abdul Ajees; Nečas, Marek; Dušek, Michal; Kučeráková, Monika; Acharya, Sudarshan Conformational analysis of two new organotin(IV) structures completed with a CSD survey Acta Crystallographica Section C, 2021, 77, 68-80 |
2022311 | CIF | C22 H30 O4 | P 21 21 21 | 11.4069; 17.9819; 19.1565 90; 90; 90 | 3929.3 | Skell, Jeffrey M.; Kahn, Michael; Foxman, Bruce M. Δ^9^-Tetrahydrocannabinolic acid A, the precursor to Δ^9^-tetrahydrocannabinol (THC) Acta Crystallographica Section C, 2021, 77, 84-89 |
2022312 | CIF HKL Paper | Al3 Ce2 Ge4 | C m c e | 6.0581; 15.045; 7.94 90; 90; 90 | 723.7 | Tobash, Paul; Bobev, Svilen The structure of Ce~2~Al~3~Ge~4~ refined for the first time from single-crystal X-ray diffraction data Acta Crystallographica Section C, 2021, 77, 81-83 |
2022313 | CIF HKL Paper | C14 H12 K2 O14 | P 1 21/c 1 | 8.3359; 17.0987; 6.5405 90; 110.687; 90 | 872.13 | Lifa, Said; Trifa, Chahrazed; Bouacida, Sofiane; Boudaren, Chaouki; Merazig, Hocine Alkali and alkaline earth coordination polymers constructed from benzene-1,2,4,5-tetracarboxylic acid and flexible dicarboxylate acid ligands: syntheses, structures and spectroscopic and thermal properties Acta Crystallographica Section C, 2021, 77, 90-99 |
2022314 | CIF HKL Paper | C12 H8 O14 Sr2 | P -1 | 7.0691; 7.8482; 7.9767 99.938; 107.918; 101.824 | 398.74 | Lifa, Said; Trifa, Chahrazed; Bouacida, Sofiane; Boudaren, Chaouki; Merazig, Hocine Alkali and alkaline earth coordination polymers constructed from benzene-1,2,4,5-tetracarboxylic acid and flexible dicarboxylate acid ligands: syntheses, structures and spectroscopic and thermal properties Acta Crystallographica Section C, 2021, 77, 90-99 |
2022315 | CIF HKL Paper | C11 H15 N3 O2 | P 1 21/c 1 | 9.874; 4.5259; 24.792 90; 94.393; 90 | 1104.7 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022316 | CIF HKL Paper | C11 H15 Cl2 Mn N3 O2 | P -1 | 12.9256; 14.278; 17.022 75.82; 78.056; 73.644 | 2890.1 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022317 | CIF HKL Paper | C26 H30 Mn2 N10 O4 S4 | P 1 21/c 1 | 7.2639; 24.655; 9.471 90; 98.994; 90 | 1675.3 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022318 | CIF HKL Paper | C13 H23 Cl2 Mn N3 O4 | P 1 21/c 1 | 10.9211; 12.0382; 15.3331 90; 109.83; 90 | 1896.3 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022319 | CIF HKL Paper | C15 H25.6 Cl2 Mn N3 O3.3 | P 1 21/c 1 | 14.4544; 8.6208; 16.9691 90; 112.426; 90 | 1954.58 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022320 | CIF HKL Paper | C20 H30 Mn N6 O3 S2 | P 1 21/c 1 | 8.5916; 8.2974; 35.1501 90; 91.731; 90 | 2504.6 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022321 | CIF HKL Paper | C23 H37 Mn N7 O4 S2 | P 1 21/c 1 | 14.9551; 11.0509; 18.4767 90; 100.043; 90 | 3006.8 | McKee, Vickie; Kose, Muhammet Manganese(II) complexes derived from acyclic ligands having flexible alcohol arms: structural chracterization and SOD and catalase mimetic studies Acta Crystallographica Section C, 2021, 77, 100-110 |
2022322 | CIF HKL Paper | C24 H20 N4 | C 1 2/c 1 | 29.76986; 8.91767; 14.70912 90; 99.2973; 90 | 3853.65 | Santana, Carlos L.; Battle, Jessica D.; Unruh, Daniel K.; Groeneman, Ryan H. Honeycomb molecular network based upon a hydrate of 4,6-dichlororesorcinol and the photoproduct <i>rtct</i>-tetrakis(pyridin-4-yl)cyclobutane Acta Crystallographica Section C, 2021, 77, 111-115 |
2022323 | CIF HKL Paper | C30 H26 Cl2 N4 O3 | P 1 21/c 1 | 13.8413; 8.9901; 21.868 90; 103.683; 90 | 2643.91 | Santana, Carlos L.; Battle, Jessica D.; Unruh, Daniel K.; Groeneman, Ryan H. Honeycomb molecular network based upon a hydrate of 4,6-dichlororesorcinol and the photoproduct <i>rtct</i>-tetrakis(pyridin-4-yl)cyclobutane Acta Crystallographica Section C, 2021, 77, 111-115 |
2022324 | CIF HKL Paper | C28 H23 N7 O13 | P 1 21 1 | 7.4532; 8.26902; 23.1876 90; 97.362; 90 | 1417.29 | Marczak, Maria; Biereg, Kinga; Zadykowicz, Beata; Sikorski, Artur Structural characterization and theoretical calculations of the monohydrate of the 1:2 cocrystal salt formed from acriflavine and 3,5-dinitrobenzoic acid Acta Crystallographica Section C, 2021, 77, 116-122 |
2022325 | CIF HKL Paper | C6 H6 Br Cl N2 O2 | P 21 21 21 | 5.72152; 7.90017; 20.2729 90; 90; 90 | 916.35 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C, 2021, 77, 125-136 |
2022326 | CIF HKL Paper | C6 H7 Cl N2 O6 S | P 1 21/c 1 | 16.1771; 4.95335; 12.8431 90; 101.584; 90 | 1008.17 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C, 2021, 77, 125-136 |
2022327 | CIF HKL Paper | C7 H9 Br N2 O2 | P -1 | 6.892; 7.7281; 8.921 76.646; 73.897; 76.045 | 436.12 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C, 2021, 77, 125-136 |
2022328 | CIF HKL Paper | C7 H9 I3 N2 O2 | P 1 21/n 1 | 7.084; 11.5247; 16.3921 90; 98.738; 90 | 1322.73 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C, 2021, 77, 125-136 |
2022329 | CIF HKL Paper | C7 H10 N2 O6 S | P 1 21/n 1 | 7.0966; 8.3785; 17.5115 90; 100.185; 90 | 1024.81 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C, 2021, 77, 125-136 |
2022330 | CIF HKL Paper | C21 H19 N4 O3 | P 1 21/c 1 | 10.575; 17.149; 10.615 90; 108.434; 90 | 1826.3 | Fidan, Ismail; Onal, Emel; Hirel, Catherine Nitroxide radicals appended to phthalonitriles: synthesis, structural characterization and photophysical properties Acta Crystallographica Section C, 2021, 77 |
2022331 | CIF HKL Paper | C34 H35 Fe2 O4 P | P 21 21 21 | 7.631; 10.877; 36.025 90; 90; 90 | 2990.2 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022332 | CIF HKL Paper | C32 H31 Fe2 O2 P S | P 21 21 21 | 7.4923; 12.0133; 31.758 90; 90; 90 | 2858.45 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022333 | CIF HKL Paper | C30 H29 Fe2 O P S | P 21 21 21 | 7.5285; 17.6463; 39.3333 90; 90; 90 | 5225.4 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022334 | CIF HKL Paper | C32 H33 Fe2 O3 P S | P 21 21 21 | 7.8204; 17.835; 20.394 90; 90; 90 | 2844.5 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022335 | CIF HKL Paper | C37 H36 Fe2 N P S | P 21 21 21 | 12.3578; 14.4342; 17.4796 90; 90; 90 | 3117.9 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022336 | CIF HKL Paper | C30 H27 Fe2 P S | P 1 21 1 | 8.4709; 14.1401; 21.031 90; 91.88; 90 | 2517.7 | Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C, 2021, 77, 152-160 |
2022337 | CIF HKL Paper | C53 H66 Cl2 Cr2 N4 O2 | P 1 21/n 1 | 14.917; 13.299; 27.554 90; 104.074; 90 | 5302.1 | Carsch, Kurtis; Elder, Shelby E.; Dogutan, Dilek K.; Nocera, Daniel G.; Yang, Junyu; Zheng, Shao-Liang; Daniel, Timothy; Betley, Theodore A. Syntheses and solid-state structures of two cofacial (bis)dipyrrin dichromium complexes in different charge states Acta Crystallographica Section C, 2021, 77, 161-166 |
2022338 | CIF HKL Paper | C65 H89 Cl2 Cr2 K2 N4 O5 | P 1 21/n 1 | 17.554; 16.64; 22.267 90; 90.785; 90 | 6503.5 | Carsch, Kurtis; Elder, Shelby E.; Dogutan, Dilek K.; Nocera, Daniel G.; Yang, Junyu; Zheng, Shao-Liang; Daniel, Timothy; Betley, Theodore A. Syntheses and solid-state structures of two cofacial (bis)dipyrrin dichromium complexes in different charge states Acta Crystallographica Section C, 2021, 77, 161-166 |
2022340 | CIF HKL Paper | Co32.32 Ge13.68 Mn28 | P n n m | 12.6208; 15.6878; 4.8338 90; 90; 90 | 957.06 | Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the <i>X</i>-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C, 2021, 77, 176-180 |
2022341 | CIF HKL Paper | Co30.97 Ge13.25 Mn29.79 | P n n m | 12.6427; 15.6725; 4.8374 90; 90; 90 | 958.5 | Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the <i>X</i>-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C, 2021, 77, 176-180 |
2022342 | CIF HKL Paper | Ni3 Se2 | R 3 2 :H | 6.02813; 6.02813; 7.24883 90; 90; 120 | 228.12 | Unoki, Kohei; Yoshiasa, Akira; Kitahara, Ginga; Nishiayama, Tadao; Tokuda, Makoto; Sugiyama, Kazumasa; Nakatsuka, Akihiko Crystal structure refinements of stoichiometric Ni~3~Se~2~ and NiSe Acta Crystallographica Section C, 2021, 77, 169-175 |
2022343 | CIF HKL Paper | Ni Se | P 63/m m c | 3.66147; 3.66147; 5.35766 90; 90; 120 | 62.204 | Unoki, Kohei; Yoshiasa, Akira; Kitahara, Ginga; Nishiayama, Tadao; Tokuda, Makoto; Sugiyama, Kazumasa; Nakatsuka, Akihiko Crystal structure refinements of stoichiometric Ni~3~Se~2~ and NiSe Acta Crystallographica Section C, 2021, 77, 169-175 |
2022344 | CIF Paper | C8 H20 Cl4 O2 W | P 1 21/n 1 | 7.5962; 11.4871; 9.0245 90; 106.339; 90 | 755.66 | Shaw, Thomas E.; Sattelberger, Alfred P.; Jurca, Titel A 35-year-old mystery solved: a facile synthetic route and structural confirmation of tetrachlorobis(diethyl ether)tungsten(IV) Acta Crystallographica Section C, 2021, 77, 181-185 |
2022345 | CIF HKL Paper | C21 H22 N O3 P | P 1 21 1 | 11.6763; 7.2768; 22.3075 90; 96.6429; 90 | 1882.66 | Lal Zakaria, Negin; Pourayoubi, Mehrdad; Eghbali Toularoud, Mahsa; Dušek, Michal; Skorepova, Eliska Structural differences/similarities of diastereotopic groups in three new chiral phosphoramides Acta Crystallographica Section C, 2021, 77, 186-196 |
2022346 | CIF HKL Paper | C21 H22 N O3 P | P 1 21 1 | 11.6739; 7.2783; 22.3071 90; 96.638; 90 | 1882.64 | Lal Zakaria, Negin; Pourayoubi, Mehrdad; Eghbali Toularoud, Mahsa; Dušek, Michal; Skorepova, Eliska Structural differences/similarities of diastereotopic groups in three new chiral phosphoramides Acta Crystallographica Section C, 2021, 77, 186-196 |
2022347 | CIF HKL Paper | C25 H28 F2 N3 O2 P | P 21 21 21 | 4.9712; 20.1758; 22.7451 90; 90; 90 | 2281.29 | Lal Zakaria, Negin; Pourayoubi, Mehrdad; Eghbali Toularoud, Mahsa; Dušek, Michal; Skorepova, Eliska Structural differences/similarities of diastereotopic groups in three new chiral phosphoramides Acta Crystallographica Section C, 2021, 77, 186-196 |
2022348 | CIF HKL Paper | C2 H4 Cl N3 O4 | P 1 21/m 1 | 5.1859; 11.8497; 9.6461 90; 96.153; 90 | 589.351 | Kumasaki, Mieko; Gontani, Saori; Mori, Kanae; Matsumoto, Shinya; Inoue, Kazuki Crystallographic study of the energetic salt 1,2,4-triazolium perchlorate Acta Crystallographica Section C, 2021, 77, 197-201 |
2022349 | CIF HKL Paper | C9 H13 N3 O4 | P 21 21 21 | 6.8378; 11.4334; 12.7595 90; 90; 90 | 997.53 | Budow-Busse, Simone; Chai, Yingying; Müller, Sebastian Lars; Daniliuc, Constantin; Seela, Frank The α-<small>D</small>-anomer of 2'-deoxycytidine: crystal structure, nucleoside conformation and Hirshfeld surface analysis Acta Crystallographica Section C, 2021, 77, 202-208 |
2022350 | CIF HKL Paper | C39 H46 N4 O6 Sn | P 1 21/c 1 | 9.4028; 25.1718; 15.5008 90; 93.3046; 90 | 3662.71 | Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C, 2021, 77, 209-220 |
2022351 | CIF HKL Paper | C40 H30 Br2 N4 O6 Sn | P 1 21/n 1 | 13.6816; 12.5767; 22.5401 90; 107.017; 90 | 3708.65 | Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C, 2021, 77, 209-220 |
2022352 | CIF HKL Paper | C50 H52 N2 O7 Sn | C 1 2/c 1 | 23.653; 10.1034; 20.5952 90; 115.072; 90 | 4458.02 | Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C, 2021, 77, 209-220 |
2022353 | CIF HKL Paper | C96 H136 N8 O16 Sn4 | P 1 21/c 1 | 11.8395; 24.2855; 17.3557 90; 93.2962; 90 | 4982 | Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C, 2021, 77, 209-220 |
2022354 | CIF HKL Paper | C72 H112 N4 O14 Sn4 | P -1 | 12.0054; 14.7309; 23.9132 76.3707; 75.5206; 88.1609 | 3977.81 | Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C, 2021, 77, 209-220 |
2022355 | CIF HKL Paper | C39 H64 Br Cu4 N5 O23 | P -1 | 9.4872; 10.7297; 25.92 89.116; 87.262; 89.258 | 2635 | Wang, Li-Fei; Liu, Xing-Gui; Meng, Mei-Mei; Xu, Yong-Kai; Zhu, Rui; Zhang, Rui; Lu, Zhen-Zhong; Huang, Wei Three coordination polymers built by quaternary-ammonium-modified isophthalic acid Acta Crystallographica Section C, 2021, 77, 221-226 |
2022356 | CIF HKL Paper | C19 H29 Br3 Cu3 N O6 | P 1 2/n 1 | 9.0572; 10.6773; 26.743 90; 95.505; 90 | 2574.3 | Wang, Li-Fei; Liu, Xing-Gui; Meng, Mei-Mei; Xu, Yong-Kai; Zhu, Rui; Zhang, Rui; Lu, Zhen-Zhong; Huang, Wei Three coordination polymers built by quaternary-ammonium-modified isophthalic acid Acta Crystallographica Section C, 2021, 77, 221-226 |
2022357 | CIF HKL Paper | C19 H28 Br N O5 Zn | P 1 21/n 1 | 11.5479; 14.7949; 12.3782 90; 99.813; 90 | 2083.9 | Wang, Li-Fei; Liu, Xing-Gui; Meng, Mei-Mei; Xu, Yong-Kai; Zhu, Rui; Zhang, Rui; Lu, Zhen-Zhong; Huang, Wei Three coordination polymers built by quaternary-ammonium-modified isophthalic acid Acta Crystallographica Section C, 2021, 77, 221-226 |
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