Search results

Formula: - C14 H11 I N2 O S -
Comments: 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 77(1) (2021) 11-19
Space group: P -1
Cell volume: 686.02
Cell parameters: 6.241; 7.242; 16.709; 84.408; 89.142; 65.933;

COD ID: 2022287

Formula: - C14 H11 I N2 O S -
Comments: 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 77(1) (2021) 11-19
Space group: P 1 c 1
Cell volume: 1357.7
Cell parameters: 4.5639; 15.375; 19.355; 90; 91.404; 90;

COD ID: 2022288

Formula: - C14 H11 I N2 O S -
Comments: 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 77(1) (2021) 11-19
Space group: P -1
Cell volume: 682.06
Cell parameters: 4.4279; 13.0767; 13.441; 61.622; 86.203; 85.241;

COD ID: 2022289

Formula: - C14 H11 Br N2 O S -
Comments: 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 77(1) (2021) 11-19
Space group: P 1 21/n 1
Cell volume: 1328.4
Cell parameters: 3.9592; 15.142; 22.25; 90; 95.183; 90;

COD ID: 2022290

Formula: - C14 H11 Br N2 O S -
Comments: 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 77(1) (2021) 11-19
Space group: P 1 c 1
Cell volume: 1328.9
Cell parameters: 4.6404; 15.017; 19.074; 90; 91.052; 90;

COD ID: 2022291

Formula: - Li2 Pb S4 Si -
Comments: 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 77(1) (2021) 1-10
Space group: I -4 2 m
Cell volume: 322.903
Cell parameters: 6.4618; 6.4618; 7.7333; 90; 90; 90;

COD ID: 2022292

Formula: - C12 H11 N5 O -
Comments: 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-a]pyridin-7-yl)-1,2,4-oxadiazole Acta Crystallographica Section C 77(1) (2021) 20-28
Space group: P 1 21/c 1
Cell volume: 1128
Cell parameters: 4.4041; 27.8787; 9.3533; 90; 100.816; 90;

COD ID: 2022293

Formula: - C12 H11 N5 O -
Comments: 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-a]pyridin-7-yl)-1,2,4-oxadiazole Acta Crystallographica Section C 77(1) (2021) 20-28
Space group: P b c a
Cell volume: 2271.9
Cell parameters: 12.2191; 8.1593; 22.788; 90; 90; 90;

COD ID: 2022297

Formula: - C11 H10 N2 O2 S -
Comments: 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 77(1) (2021) 40-48
Space group: P 21 21 21
Cell volume: 1066.4
Cell parameters: 3.9876; 10.6511; 25.107; 90; 90; 90;

COD ID: 2022298

Formula: - C11 H10 N2 O2 S -
Comments: 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 77(1) (2021) 40-48
Space group: P b c a
Cell volume: 2123.5
Cell parameters: 6.921; 7.2371; 42.396; 90; 90; 90;

COD ID: 2022299

Formula: - C14 H14 N2 O3 -
Comments: Sugiyama, Haruki; Uekusa, Hidehiro Two-step crystal‒crystal phase transformation of N-salicylidene-p-aminobenzoic acid by gas‒solid reaction with aqua‒ammonia vapour Acta Crystallographica Section C 77(1) (2021) 56-60
Space group: C 1 2/c 1
Cell volume: 2501.8
Cell parameters: 43.803; 4.6835; 12.2643; 90; 96.105; 90;

COD ID: 2022300

Formula: - C16 H14 N8 S6 -
Comments: 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 77(1) (2021) 49-55
Space group: C 1 2/c 1
Cell volume: 2052.18
Cell parameters: 12.3039; 6.4431; 25.9547; 90; 94.145; 90;

COD ID: 2022301

Formula: - C11 H13 N5 O S3 -
Comments: 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 77(1) (2021) 49-55
Space group: P 1 21/c 1
Cell volume: 2934.59
Cell parameters: 24.5777; 8.9406; 13.3772; 90; 93.313; 90;

COD ID: 2022302

Formula: - C12 H10 N6 -
Comments: 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 77(1) (2021) 29-39
Space group: P 1 21/c 1
Cell volume: 1113.49
Cell parameters: 13.7529; 6.6451; 12.2086; 90; 93.634; 90;

COD ID: 2022303

Formula: - C26 H24 Cl8 N12 Zn2 -
Comments: 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 77(1) (2021) 29-39
Space group: C 1 2/c 1
Cell volume: 3722.6
Cell parameters: 30.503; 8.8791; 15.4063; 90; 116.856; 90;

COD ID: 2022304

Formula: - C50 H42 Cl14 N24 Zn4 -
Comments: 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 77(1) (2021) 29-39
Space group: P 1 21/n 1
Cell volume: 3504
Cell parameters: 13.414; 18.504; 14.674; 90; 105.834; 90;

COD ID: 2022305

Formula: - C26 H24 Cl4 I4 N12 Zn2 -
Comments: 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 77(1) (2021) 29-39
Space group: C 1 2/c 1
Cell volume: 4024
Cell parameters: 30.312; 9.461; 15.434; 90; 114.625; 90;

COD ID: 2022306

Formula: - C13 H11 Cl3 I2 N6 Zn -
Comments: 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 77(1) (2021) 29-39
Space group: P -1
Cell volume: 1026
Cell parameters: 9.804; 11.35; 11.35; 69.43; 65.912; 65.912;

COD ID: 2022307

Formula: - C70 H70 Cl4 Cu4 I4 N2 O2 P4 -
Comments: 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 77(2) (2021) 61-67
Space group: P -1
Cell volume: 1915.1
Cell parameters: 11.95; 12.443; 13.06; 83.43; 86.3; 83.76;

COD ID: 2022308

Formula: - C68 H66 Cu4 I4 N2 O2 P4 -
Comments: 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 77(2) (2021) 61-67
Space group: P -1
Cell volume: 1693.1
Cell parameters: 11.981; 12.996; 13.23; 62.49; 68.32; 83.71;

COD ID: 2022309

Formula: - C14 H38 Cl4 N2 Sn -
Comments: 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 77(2) (2021) 68-80
Space group: P 1 21/n 1
Cell volume: 2441.54
Cell parameters: 10.9199; 13.1459; 17.8167; 90; 107.328; 90;

COD ID: 2022310

Formula: - C44 H48 Cl8 N6 O2 P2 Sn -
Comments: 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 77(2) (2021) 68-80
Space group: P 1 21/n 1
Cell volume: 2510.49
Cell parameters: 15.4589; 8.1983; 20.6655; 90; 106.556; 90;

COD ID: 2022311
CIF file	Formula: - C22 H30 O4 - Comments: Skell, Jeffrey M.; Kahn, Michael; Foxman, Bruce M. Δ^9^-Tetrahydrocannabinolic acid A, the precursor to Δ^9^-tetrahydrocannabinol (THC) Acta Crystallographica Section C 77(2) (2021) 84-89 Space group: P 21 21 21 Cell volume: 3929.3 Cell parameters: 11.4069; 17.9819; 19.1565; 90; 90; 90;

COD ID: 2022312

Formula: - Al3 Ce2 Ge4 -
Comments: 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 77(2) (2021) 81-83
Space group: C m c e
Cell volume: 723.7
Cell parameters: 6.0581; 15.045; 7.94; 90; 90; 90;

COD ID: 2022313

Formula: - C14 H12 K2 O14 -
Comments: 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 77(2) (2021) 90-99
Space group: P 1 21/c 1
Cell volume: 872.13
Cell parameters: 8.3359; 17.0987; 6.5405; 90; 110.687; 90;

COD ID: 2022314

Formula: - C12 H8 O14 Sr2 -
Comments: 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 77(2) (2021) 90-99
Space group: P -1
Cell volume: 398.74
Cell parameters: 7.0691; 7.8482; 7.9767; 99.938; 107.918; 101.824;

COD ID: 2022315

Formula: - C11 H15 N3 O2 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 1104.7
Cell parameters: 9.874; 4.5259; 24.792; 90; 94.393; 90;

COD ID: 2022316

Formula: - C11 H15 Cl2 Mn N3 O2 -
Comments: 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 77(2) (2021) 100-110
Space group: P -1
Cell volume: 2890.1
Cell parameters: 12.9256; 14.278; 17.022; 75.82; 78.056; 73.644;

COD ID: 2022317

Formula: - C26 H30 Mn2 N10 O4 S4 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 1675.3
Cell parameters: 7.2639; 24.655; 9.471; 90; 98.994; 90;

COD ID: 2022318

Formula: - C13 H23 Cl2 Mn N3 O4 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 1896.3
Cell parameters: 10.9211; 12.0382; 15.3331; 90; 109.83; 90;

COD ID: 2022319

Formula: - C15 H25.6 Cl2 Mn N3 O3.3 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 1954.58
Cell parameters: 14.4544; 8.6208; 16.9691; 90; 112.426; 90;

COD ID: 2022320

Formula: - C20 H30 Mn N6 O3 S2 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 2504.6
Cell parameters: 8.5916; 8.2974; 35.1501; 90; 91.731; 90;

COD ID: 2022321

Formula: - C23 H37 Mn N7 O4 S2 -
Comments: 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 77(2) (2021) 100-110
Space group: P 1 21/c 1
Cell volume: 3006.8
Cell parameters: 14.9551; 11.0509; 18.4767; 90; 100.043; 90;

COD ID: 2022322

Formula: - C24 H20 N4 -
Comments: 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 rtct-tetrakis(pyridin-4-yl)cyclobutane Acta Crystallographica Section C 77(2) (2021) 111-115
Space group: C 1 2/c 1
Cell volume: 3853.65
Cell parameters: 29.76986; 8.91767; 14.70912; 90; 99.2973; 90;

COD ID: 2022323

Formula: - C30 H26 Cl2 N4 O3 -
Comments: 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 rtct-tetrakis(pyridin-4-yl)cyclobutane Acta Crystallographica Section C 77(2) (2021) 111-115
Space group: P 1 21/c 1
Cell volume: 2643.91
Cell parameters: 13.8413; 8.9901; 21.868; 90; 103.683; 90;

COD ID: 2022324

Formula: - C28 H23 N7 O13 -
Comments: 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 77(2) (2021) 116-122
Space group: P 1 21 1
Cell volume: 1417.29
Cell parameters: 7.4532; 8.26902; 23.1876; 90; 97.362; 90;

COD ID: 2022325

Formula: - C6 H6 Br Cl N2 O2 -
Comments: Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C 77(3) (2021) 125-136
Space group: P 21 21 21
Cell volume: 916.35
Cell parameters: 5.72152; 7.90017; 20.2729; 90; 90; 90;

COD ID: 2022326

Formula: - C6 H7 Cl N2 O6 S -
Comments: Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C 77(3) (2021) 125-136
Space group: P 1 21/c 1
Cell volume: 1008.17
Cell parameters: 16.1771; 4.95335; 12.8431; 90; 101.584; 90;

COD ID: 2022327

Formula: - C7 H9 Br N2 O2 -
Comments: Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C 77(3) (2021) 125-136
Space group: P -1
Cell volume: 436.12
Cell parameters: 6.892; 7.7281; 8.921; 76.646; 73.897; 76.045;

COD ID: 2022328

Formula: - C7 H9 I3 N2 O2 -
Comments: Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C 77(3) (2021) 125-136
Space group: P 1 21/n 1
Cell volume: 1322.73
Cell parameters: 7.084; 11.5247; 16.3921; 90; 98.738; 90;

COD ID: 2022329

Formula: - C7 H10 N2 O6 S -
Comments: Medviediev, Volodymyr; Daszkiewicz, Marek Structural and theoretical analysis of 2-chloro-4-nitroaniline and 2-methyl-6-nitroaniline salts Acta Crystallographica Section C 77(3) (2021) 125-136
Space group: P 1 21/n 1
Cell volume: 1024.81
Cell parameters: 7.0966; 8.3785; 17.5115; 90; 100.185; 90;

COD ID: 2022330

Formula: - C21 H19 N4 O3 -
Comments: Fidan, Ismail; Onal, Emel; Hirel, Catherine Nitroxide radicals appended to phthalonitriles: synthesis, structural characterization and photophysical properties Acta Crystallographica Section C 77(3) (2021)
Space group: P 1 21/c 1
Cell volume: 1826.3
Cell parameters: 10.575; 17.149; 10.615; 90; 108.434; 90;

COD ID: 2022331

Formula: - C34 H35 Fe2 O4 P -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 21 21 21
Cell volume: 2990.2
Cell parameters: 7.631; 10.877; 36.025; 90; 90; 90;

COD ID: 2022332

Formula: - C32 H31 Fe2 O2 P S -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 21 21 21
Cell volume: 2858.45
Cell parameters: 7.4923; 12.0133; 31.758; 90; 90; 90;

COD ID: 2022333

Formula: - C30 H29 Fe2 O P S -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 21 21 21
Cell volume: 5225.4
Cell parameters: 7.5285; 17.6463; 39.3333; 90; 90; 90;

COD ID: 2022334

Formula: - C32 H33 Fe2 O3 P S -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 21 21 21
Cell volume: 2844.5
Cell parameters: 7.8204; 17.835; 20.394; 90; 90; 90;

COD ID: 2022335

Formula: - C37 H36 Fe2 N P S -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 21 21 21
Cell volume: 3117.9
Cell parameters: 12.3578; 14.4342; 17.4796; 90; 90; 90;

COD ID: 2022336

Formula: - C30 H27 Fe2 P S -
Comments: Honegger, Philipp; Roller, Alexander; Widhalm, Michael Synthesis and characterization of enantiopure planar‒chiral phosphorus-linked diferrocenes Acta Crystallographica Section C 77(3) (2021) 152-160
Space group: P 1 21 1
Cell volume: 2517.7
Cell parameters: 8.4709; 14.1401; 21.031; 90; 91.88; 90;

COD ID: 2022337

Formula: - C53 H66 Cl2 Cr2 N4 O2 -
Comments: 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 77(3) (2021) 161-166
Space group: P 1 21/n 1
Cell volume: 5302.1
Cell parameters: 14.917; 13.299; 27.554; 90; 104.074; 90;

COD ID: 2022338

Formula: - C65 H89 Cl2 Cr2 K2 N4 O5 -
Comments: 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 77(3) (2021) 161-166
Space group: P 1 21/n 1
Cell volume: 6503.5
Cell parameters: 17.554; 16.64; 22.267; 90; 90.785; 90;

COD ID: 2022340

Formula: - Co32.32 Ge13.68 Mn28 -
Comments: Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the X-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C 77(4) (2021) 176-180
Space group: P n n m
Cell volume: 957.06
Cell parameters: 12.6208; 15.6878; 4.8338; 90; 90; 90;

COD ID: 2022341

Formula: - Co30.97 Ge13.25 Mn29.79 -
Comments: Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the X-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C 77(4) (2021) 176-180
Space group: P n n m
Cell volume: 958.5
Cell parameters: 12.6427; 15.6725; 4.8374; 90; 90; 90;

COD ID: 2022342

Formula: - Ni3 Se2 -
Comments: 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 77(4) (2021) 169-175
Space group: R 3 2 :H
Cell volume: 228.12
Cell parameters: 6.02813; 6.02813; 7.24883; 90; 90; 120;

COD ID: 2022343

Formula: - Ni Se -
Comments: 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 77(4) (2021) 169-175
Space group: P 63/m m c
Cell volume: 62.204
Cell parameters: 3.66147; 3.66147; 5.35766; 90; 90; 120;

COD ID: 2022344
CIF file Original IUCr paper	Formula: - C8 H20 Cl4 O2 W - Comments: 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 77(4) (2021) 181-185 Space group: P 1 21/n 1 Cell volume: 755.66 Cell parameters: 7.5962; 11.4871; 9.0245; 90; 106.339; 90;

COD ID: 2022345

Formula: - C21 H22 N O3 P -
Comments: 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 77(4) (2021) 186-196
Space group: P 1 21 1
Cell volume: 1882.66
Cell parameters: 11.6763; 7.2768; 22.3075; 90; 96.6429; 90;

COD ID: 2022346

Formula: - C21 H22 N O3 P -
Comments: 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 77(4) (2021) 186-196
Space group: P 1 21 1
Cell volume: 1882.64
Cell parameters: 11.6739; 7.2783; 22.3071; 90; 96.638; 90;

COD ID: 2022347

Formula: - C25 H28 F2 N3 O2 P -
Comments: 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 77(4) (2021) 186-196
Space group: P 21 21 21
Cell volume: 2281.29
Cell parameters: 4.9712; 20.1758; 22.7451; 90; 90; 90;

COD ID: 2022348

Formula: - C2 H4 Cl N3 O4 -
Comments: 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 77(5) (2021) 197-201
Space group: P 1 21/m 1
Cell volume: 589.351
Cell parameters: 5.1859; 11.8497; 9.6461; 90; 96.153; 90;

COD ID: 2022349

Formula: - C9 H13 N3 O4 -
Comments: Budow-Busse, Simone; Chai, Yingying; Müller, Sebastian Lars; Daniliuc, Constantin; Seela, Frank The α-D-anomer of 2'-deoxycytidine: crystal structure, nucleoside conformation and Hirshfeld surface analysis Acta Crystallographica Section C 77(5) (2021) 202-208
Space group: P 21 21 21
Cell volume: 997.53
Cell parameters: 6.8378; 11.4334; 12.7595; 90; 90; 90;

COD ID: 2022350

Formula: - C39 H46 N4 O6 Sn -
Comments: Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C 77(5) (2021) 209-220
Space group: P 1 21/c 1
Cell volume: 3662.71
Cell parameters: 9.4028; 25.1718; 15.5008; 90; 93.3046; 90;

COD ID: 2022351

Formula: - C40 H30 Br2 N4 O6 Sn -
Comments: Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C 77(5) (2021) 209-220
Space group: P 1 21/n 1
Cell volume: 3708.65
Cell parameters: 13.6816; 12.5767; 22.5401; 90; 107.017; 90;

COD ID: 2022352

Formula: - C50 H52 N2 O7 Sn -
Comments: Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C 77(5) (2021) 209-220
Space group: C 1 2/c 1
Cell volume: 4458.02
Cell parameters: 23.653; 10.1034; 20.5952; 90; 115.072; 90;

COD ID: 2022353

Formula: - C96 H136 N8 O16 Sn4 -
Comments: Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C 77(5) (2021) 209-220
Space group: P 1 21/c 1
Cell volume: 4982
Cell parameters: 11.8395; 24.2855; 17.3557; 90; 93.2962; 90;

COD ID: 2022354

Formula: - C72 H112 N4 O14 Sn4 -
Comments: Linden, Anthony; Basu Baul, Tushar S. Structural diversity among some dialkyltin(IV) benzoate and related derivatives Acta Crystallographica Section C 77(5) (2021) 209-220
Space group: P -1
Cell volume: 3977.81
Cell parameters: 12.0054; 14.7309; 23.9132; 76.3707; 75.5206; 88.1609;

COD ID: 2022355

Formula: - C39 H64 Br Cu4 N5 O23 -
Comments: 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 77(5) (2021) 221-226
Space group: P -1
Cell volume: 2635
Cell parameters: 9.4872; 10.7297; 25.92; 89.116; 87.262; 89.258;

COD ID: 2022356

Formula: - C19 H29 Br3 Cu3 N O6 -
Comments: 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 77(5) (2021) 221-226
Space group: P 1 2/n 1
Cell volume: 2574.3
Cell parameters: 9.0572; 10.6773; 26.743; 90; 95.505; 90;

COD ID: 2022357

Formula: - C19 H28 Br N O5 Zn -
Comments: 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 77(5) (2021) 221-226
Space group: P 1 21/n 1
Cell volume: 2083.9
Cell parameters: 11.5479; 14.7949; 12.3782; 90; 99.813; 90;

COD ID: 2022358

Formula: - Al0.33 Li4 Mg Si -
Comments: Pavlyuk, Volodymyr; Ciesielski, Wojciech; Kulawik, Damian; Pavlyuk, Nazar; Dmytriv, Grygoriy Structural and enhanced hydrogen storage properties of the Li~12~Mg~3~Si~3~Al phase Acta Crystallographica Section C 77(5) (2021) 227-234
Space group: I -4 3 d
Cell volume: 1236.69
Cell parameters: 10.7338; 10.7338; 10.7338; 90; 90; 90;

COD ID: 2022363

Formula: - C30 H36 Cd Cl2 Fe O P2 -
Comments: Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P. Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands Acta Crystallographica Section C 77(5) (2021) 240-248
Space group: P -1
Cell volume: 1501.86
Cell parameters: 9.8113; 9.8273; 16.6898; 91.454; 106.989; 101.534;

COD ID: 2022364

Formula: - C52 H54 Cl2 Fe2 O6 P4 Zn2 -
Comments: Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P. Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands Acta Crystallographica Section C 77(5) (2021) 240-248
Space group: P -1
Cell volume: 1561.97
Cell parameters: 10.8762; 11.3163; 13.5343; 83.078; 87.002; 70.848;

COD ID: 2022365

Formula: - C26 H44 Fe P2 S2 -
Comments: Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P. Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands Acta Crystallographica Section C 77(5) (2021) 240-248
Space group: P 1 21/c 1
Cell volume: 2718
Cell parameters: 14.7589; 14.0445; 14.7141; 90; 116.982; 90;

COD ID: 2022366

Formula: - C35.75 H52 Cl0.25 Fe N1.75 P2 Zn -
Comments: Chaudhary, Karan; Trivedi, Manoj; Masram, Dhanraj T.; Rath, Nigam P. Transition-metal complexes of group 12 with 1,1'-bis(phosphanyl)ferrocene ligands Acta Crystallographica Section C 77(5) (2021) 240-248
Space group: P 1 21/m 1
Cell volume: 1646.9
Cell parameters: 8.2992; 21.6504; 9.9175; 90; 112.451; 90;

COD ID: 2022367

Formula: - B8 Eu Na3 O15 -
Comments: Bi, Wen-Yan; Wang, Wei; Zhang, Rui-Juan New red phosphor Na~3~EuB~8~O~15~ with an open-window tubular structure Acta Crystallographica Section C 77(5) (2021) 235-239
Space group: P -1
Cell volume: 573.81
Cell parameters: 6.2861; 7.5366; 13.4963; 90.547; 100.667; 113.489;

COD ID: 2022368

Formula: - C5 H7 N3 S2 -
Comments: Slyvka, Yurii; Kinzhybalo, Vasyl; Shyyka, Olga; Mys'kiv, Marian Synthesis, structure and computational study of 5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-amine (Pesta) and its heterometallic π,σ-complex [Cu~2~FeCl~2~(Pesta)~4~][FeCl~4~] Acta Crystallographica Section C 77(5) (2021) 249-256
Space group: P -1
Cell volume: 383.9
Cell parameters: 6.088; 7.826; 8.623; 79.8; 72.96; 80.62;

COD ID: 2022369

Formula: - C20 H28 Cl6 Cu2 Fe2 N12 S8 -
Comments: Slyvka, Yurii; Kinzhybalo, Vasyl; Shyyka, Olga; Mys'kiv, Marian Synthesis, structure and computational study of 5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-amine (Pesta) and its heterometallic π,σ-complex [Cu~2~FeCl~2~(Pesta)~4~][FeCl~4~] Acta Crystallographica Section C 77(5) (2021) 249-256
Space group: C 1 2/c 1
Cell volume: 3981
Cell parameters: 17.65; 10.686; 21.107; 90; 90.15; 90;

COD ID: 2022370

Formula: - C7 H5 Br O3 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: P 1 21/n 1
Cell volume: 716.01
Cell parameters: 3.8053; 14.661; 12.9396; 90; 97.32; 90;

COD ID: 2022371

Formula: - C7 H5 Br O3 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: P -1
Cell volume: 362.44
Cell parameters: 6.9581; 7.1413; 8.0284; 81.959; 73.812; 71.352;

COD ID: 2022372

Formula: - C7 H4 Br2 O3 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: C 1 2/c 1
Cell volume: 1635.55
Cell parameters: 10.3703; 10.9444; 14.8108; 90; 103.35; 90;

COD ID: 2022373

Formula: - C22 H28 Br N O7 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: P 1 21 1
Cell volume: 1107.86
Cell parameters: 9.9325; 9.0196; 12.3942; 90; 93.844; 90;

COD ID: 2022374

Formula: - C22 H27 Br2 N O7 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: P 1 21 1
Cell volume: 1167.77
Cell parameters: 9.522; 9.3214; 13.3453; 90; 99.6446; 90;

COD ID: 2022375

Formula: - C22 H28 Br N O7 -
Comments: Roy, Monalisa; Li, Keyao; Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D. Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids Acta Crystallographica Section C 77(6) (2021) 262-270
Space group: P 1 21 1
Cell volume: 1132.99
Cell parameters: 11.0814; 9.28293; 11.1404; 90; 98.638; 90;

COD ID: 2022376

Formula: - C32 H24 Cd N4 O5 -
Comments: Wu, Ji-Pei; Cheng, Yi-Chuan; Lu, Lei; Wang, Jun; Qiao, Shan-Bao A fourfold interpenetrating three-dimensional cadmium(II) coordination polymer: synthesis, crystal structure and physical properties Acta Crystallographica Section C 77(6) (2021) 257-261
Space group: P 43
Cell volume: 2865.6
Cell parameters: 10.6631; 10.6631; 25.203; 90; 90; 90;

COD ID: 2022378

Formula: - C12 H8 N2 O4 Se -
Comments: Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J. Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis Acta Crystallographica Section C 77(6) (2021)
Space group: P -1
Cell volume: 588.04
Cell parameters: 7.653; 7.8066; 11.5939; 76.603; 88.358; 61.263;

COD ID: 2022379

Formula: - C12 H12 N2 Se -
Comments: Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J. Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis Acta Crystallographica Section C 77(6) (2021)
Space group: P 1 21/n 1
Cell volume: 1075.45
Cell parameters: 8.4557; 7.053; 18.0521; 90; 92.643; 90;

COD ID: 2022380

Formula: - C12 H12 N2 Te -
Comments: Saravanan, Raju; Singh, Harkesh B.; Butcher, Ray J. Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis Acta Crystallographica Section C 77(6) (2021)
Space group: P -1
Cell volume: 558.9
Cell parameters: 7.0048; 8.6062; 10.1392; 66.164; 88.628; 88.78;

COD ID: 2022381

Formula: - C23 H29 O12.5 Pb2 -
Comments: Sun, Yanwen; Chen, Zhen; Wang, Xiaozhong; Wang, Lei; Yang, Xue; Liang, Xiaoting; Fan, Shuangshuang; Zhang, Peiran Novel Ba^2+^ and Pb^2+^ metal‒organic frameworks based on a semi-rigid tetracarboxylic acid: syntheses, structures, topologies and luminescence properties Acta Crystallographica Section C 77(6) (2021) 291-298
Space group: P 1 21/n 1
Cell volume: 2564.1
Cell parameters: 11.607; 14.951; 15.017; 90; 100.287; 90;

COD ID: 2022382

Formula: - C26 H41 Ba2 N O16 -
Comments: Sun, Yanwen; Chen, Zhen; Wang, Xiaozhong; Wang, Lei; Yang, Xue; Liang, Xiaoting; Fan, Shuangshuang; Zhang, Peiran Novel Ba^2+^ and Pb^2+^ metal‒organic frameworks based on a semi-rigid tetracarboxylic acid: syntheses, structures, topologies and luminescence properties Acta Crystallographica Section C 77(6) (2021) 291-298
Space group: P 1 21/n 1
Cell volume: 3301.6
Cell parameters: 15.826; 13.033; 16.03; 90; 93.074; 90;

COD ID: 2022383

Formula: - C17 H17 N O3 -
Comments: Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives Acta Crystallographica Section C 77(6) (2021)
Space group: P 1 21/c 1
Cell volume: 1423.05
Cell parameters: 11.675; 8.6138; 14.1504; 90; 90.075; 90;

COD ID: 2022384

Formula: - C16 H17 N O3 -
Comments: Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives Acta Crystallographica Section C 77(6) (2021)
Space group: P 1 21/n 1
Cell volume: 1443.97
Cell parameters: 8.9227; 12.8741; 12.5994; 90; 93.897; 90;

COD ID: 2022385

Formula: - C15 H14 Br N O3 -
Comments: Bargavi, Srinivasan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Lakshmi, Srinivasakannan Synthesis, spectroscopic investigation, crystal structure analysis, quantum chemical study, biological activity and molecular docking of three isatin derivatives Acta Crystallographica Section C 77(6) (2021)
Space group: P n a 21
Cell volume: 1412.99
Cell parameters: 7.896; 19.6458; 9.1088; 90; 90; 90;

COD ID: 2022387

Formula: - C37 H34 Cu I N2 P2 S -
Comments: Liang, Yu; Wang, Jian-Teng; Song, Li; Dai, Ding-Qiu; Wang, You-Yu; Chai, Wen-Xiang Structural, spectroscopic and DFT theoretical studies of phosphorescent CuIP~2~S-containing cuprous complexes Acta Crystallographica Section C 77(7) (2021)
Space group: P -1
Cell volume: 1725.76
Cell parameters: 9.7713; 11.8827; 16.0872; 85.185; 80.369; 69.634;

COD ID: 2022388

Formula: - C43 H36 Cu I N2 P2 S -
Comments: Liang, Yu; Wang, Jian-Teng; Song, Li; Dai, Ding-Qiu; Wang, You-Yu; Chai, Wen-Xiang Structural, spectroscopic and DFT theoretical studies of phosphorescent CuIP~2~S-containing cuprous complexes Acta Crystallographica Section C 77(7) (2021)
Space group: P 1 21/n 1
Cell volume: 7699.4
Cell parameters: 10.9718; 15.9975; 44.0539; 90; 95.2989; 90;

COD ID: 2022389

Formula: - C10 H11 Cl2 N3 Zn -
Comments: Małecka, Magdalena; Kusz, Joachim; Mayer, Peter; Sobiesiak, Marta; Budzisz, Elzbieta Zinc(II) and nickel(II) complexes of 3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazole: relationship between fluorescence and crystal packing Acta Crystallographica Section C Structural Chemistry 77(7) (2021)
Space group: P -1
Cell volume: 611.87
Cell parameters: 7.4115; 8.5345; 10.779; 89.682; 72.145; 71.405;

COD ID: 2022390

Formula: - C20 H26 Cl2 N6 Ni O2 -
Comments: Małecka, Magdalena; Kusz, Joachim; Mayer, Peter; Sobiesiak, Marta; Budzisz, Elzbieta Zinc(II) and nickel(II) complexes of 3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazole: relationship between fluorescence and crystal packing Acta Crystallographica Section C Structural Chemistry 77(7) (2021)
Space group: P 1 21/c 1
Cell volume: 2238.5
Cell parameters: 12.2306; 13.2638; 14.056; 90; 100.981; 90;

COD ID: 2022391

Formula: - C32 H72.64 Cl Eu3 N8 Na O32.04 -
Comments: Thomsen, Maria Storm; Madsen, Anders Ø.; Sørensen, Thomas Just Crystal structure and optical properties of a two-sited Eu^III^ compound: an Eu^III^ ion coordinated by two [Eu^III^(DOTA)]^{-^} complexes (DOTA is 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate) Acta Crystallographica Section C 77(7) (2021)
Space group: P -1
Cell volume: 2674.9
Cell parameters: 9.2252; 16.937; 17.274; 96.37; 92.39; 93.26;

COD ID: 2022392
CIF file Original IUCr paper	Formula: - C33 H22 O - Comments: Shi, Linqi; Sun, Zipei; Tian, Jiajie; Huang, Yaodong; Meng, Jiben Study of naphthopyran derivatives: structure and photochromic properties in solution and in polymer film Acta Crystallographica Section C 77(7) (2021) Space group: P -1 Cell volume: 1110.7 Cell parameters: 9.99; 10.7; 11.016; 80.865; 73.669; 82.3;

COD ID: 2022393
CIF file Original IUCr paper	Formula: - C37 H26 O - Comments: Shi, Linqi; Sun, Zipei; Tian, Jiajie; Huang, Yaodong; Meng, Jiben Study of naphthopyran derivatives: structure and photochromic properties in solution and in polymer film Acta Crystallographica Section C 77(7) (2021) Space group: P 1 21/n 1 Cell volume: 5178 Cell parameters: 10.96; 23.88; 20.385; 90; 103.941; 90;

COD ID: 2022394

Formula: - C24 H48 Cl4 O7 Ti2 -
Comments: Bloomfield, Hannah R.; Hollett, Joshua W.; Ritch, Jamie S. Crystal structure and computational study of an oxo-bridged bis-titanium(III) complex Acta Crystallographica Section C 77(7) (2021)
Space group: C 1 2/c 1
Cell volume: 3207.84
Cell parameters: 19.1347; 9.1227; 18.7937; 90; 102.092; 90;

COD ID: 2022395

Formula: - C16 H22 Br2 Cu N14 O4 -
Comments: Parisi, Emmanuele; Centore, Roberto Stabilization of an elusive tautomer by metal coordination Acta Crystallographica Section C 77(7) (2021)
Space group: C 1 c 1
Cell volume: 2534.9
Cell parameters: 11.062; 8.369; 27.406; 90; 92.44; 90;

COD ID: 2022396

Formula: - C16 H16 Br2 N14 O Zn -
Comments: Parisi, Emmanuele; Centore, Roberto Stabilization of an elusive tautomer by metal coordination Acta Crystallographica Section C 77(7) (2021)
Space group: P -1
Cell volume: 1138.2
Cell parameters: 8.396; 12.305; 12.724; 112.53; 107.78; 92.16;

COD ID: 2022397

Formula: - C24 H34 Cl N O2 -
Comments: Hudnall, Todd W.; Reinheimer, Eric W.; Dorsey, Christopher L. Synthesis, crystal structure determination, and spectroscopic analyses of 1-chloro-2-(2,6-diisopropylphenyl)-4,4-dimethyl-2-azaspiro[5.5]undecane-3,5-dione: an unyielding precursor to a cyclic (alkyl)(amido)carbene Acta Crystallographica Section C 77(7) (2021)
Space group: P 1 21/c 1
Cell volume: 2188.5
Cell parameters: 13.4563; 10.7847; 15.5656; 90; 104.341; 90;

COD ID: 2022398

Formula: - C6 H56 N2 Na5 O46 Sb W6 -
Comments: Sifaki, Kleanthi; Gumerova, Nadiia I.; Giester, Gerald; Rompel, Annette Synthesis and characterization of the Anderson‒Evans tungstoantimonate [Na~5~(H~2~O)~18~{(HOCH~2~)~2~CHNH~3~}~2~][SbW~6~O~24~] Acta Crystallographica Section C 77(7) (2021)
Space group: C 1 2/c 1
Cell volume: 4622.5
Cell parameters: 21.9761; 13.9179; 16.209; 90; 111.189; 90;

COD ID: 2022399

Formula: - C63 H66 N14 O24 Zn -
Comments: Perić, Berislav; Kokan, Zoran; Kirin, Srećko I. Induction of Λ-helicity in a zinc complex with an alanine-appended aminopyridine ligand Acta Crystallographica Section C 77(8) (2021)
Space group: P 1 21 1
Cell volume: 3460.78
Cell parameters: 10.5897; 22.8595; 14.3102; 90; 92.524; 90;

COD ID: 2022400

Formula: - C29 H34 Cl2 N4 O3 -
Comments: Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors Acta Crystallographica Section C 77(8) (2021)
Space group: P 1 21/n 1
Cell volume: 2763.55
Cell parameters: 8.9645; 33.8111; 9.2237; 90; 98.698; 90;

COD ID: 2022401

Formula: - C29 H31 N5 O5 -
Comments: Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors Acta Crystallographica Section C 77(8) (2021)
Space group: P 1 21/c 1
Cell volume: 2563.02
Cell parameters: 21.7033; 7.219; 16.821; 90; 103.464; 90;

COD ID: 2022402

Formula: - C31 H33 N5 O4 -
Comments: Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors Acta Crystallographica Section C 77(8) (2021)
Space group: P 1 21/n 1
Cell volume: 2736.74
Cell parameters: 8.8799; 23.555; 13.2498; 90; 99.072; 90;

COD ID: 2022403

Formula: - C32 H39.23 Cl2 N4 O2.61 -
Comments: Żesławska, Ewa; Szymańska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors Acta Crystallographica Section C 77(8) (2021)
Space group: P 1 21/c 1
Cell volume: 3005.46
Cell parameters: 11.8717; 33.6944; 7.6888; 90; 102.259; 90;

COD ID: 2022404

Formula: - C36 H30 N12 S12 -
Comments: Wzgarda-Raj, Kinga; Ksiażkiewicz, Olga; Palusiak, Marcin A rare case of a 2:2:1 ternary cocrystal of pyridine sulfides and trithiocyanuric acid Acta Crystallographica Section C 77(8) (2021)
Space group: P -1
Cell volume: 2210.08
Cell parameters: 9.8898; 15.8351; 16.4327; 111.84; 99.655; 104.689;

COD ID: 2022405

Formula: - C30 H17 F3 N2 O2 -
Comments: Bosch, Eric; Bowling, Nathan P.; Oburn, Shalisa M. Conformational control through co-operative nonconventional C—H···N hydrogen bonds Acta Crystallographica Section C 77(8) (2021)
Space group: P -1
Cell volume: 1150.3
Cell parameters: 8.0037; 12.1365; 13.4922; 104.697; 103.023; 106.619;

COD ID: 2022406

Formula: - C9 H18 O5 -
Comments: Lin, Jieye; Oliver, Allen G.; Meredith, Reagan J.; Carmichael, Ian; Serianni, Anthony S. Isopropyl 3-deoxy-α-D-ribo-hexopyranoside (isopropyl 3-deoxy-α-D-glucopyranoside): evaluating trends in structural parameters Acta Crystallographica Section C 77(8) (2021)
Space group: I 1 2 1
Cell volume: 1056
Cell parameters: 13.7349; 5.0575; 16.08; 90; 109.02; 90;

COD ID: 2022407

Formula: - C23 H21 F N2 O4 -
Comments: Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene Acta Crystallographica Section C Structural Chemistry 77(9) (2021)
Space group: P -1
Cell volume: 945.52
Cell parameters: 8.144; 8.4565; 14.9945; 87.549; 79.926; 68.467;

COD ID: 2022408

Formula: - C24 H24 N2 O4 -
Comments: Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene Acta Crystallographica Section C Structural Chemistry 77(9) (2021)
Space group: P -1
Cell volume: 982.15
Cell parameters: 8.1874; 8.5015; 15.5775; 85.775; 77.641; 68.022;

COD ID: 2022409

Formula: - C24 H24 N2 O4 -
Comments: Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene Acta Crystallographica Section C Structural Chemistry 77(9) (2021)
Space group: P -1
Cell volume: 988.16
Cell parameters: 8.6535; 9.2064; 14.4327; 72.66; 74.539; 65.93;

COD ID: 2022410

Formula: - C24 H23 Cl N2 O4 -
Comments: Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene Acta Crystallographica Section C Structural Chemistry 77(9) (2021)
Space group: P -1
Cell volume: 1023.83
Cell parameters: 8.7914; 9.3155; 14.6188; 73.437; 76.259; 64.156;

COD ID: 2022411

Formula: - C29 H34 N2 O4 -
Comments: Romo, Pablo E.; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Synthesis and spectroscopic and structural characterization of spiro[indoline-3,3′-indolizine]s formed by 1,3-dipolar cycloadditions between isatins, pipecolic acid and an electron-deficient alkene Acta Crystallographica Section C Structural Chemistry 77(9) (2021)
Space group: P 1 21/n 1
Cell volume: 2509.89
Cell parameters: 11.0442; 17.4707; 13.0081; 90; 90.215; 90;

COD ID: 2022412

Formula: - C20 H20 O8 -
Comments: Toklo, Placide M.; Yayi Ladekan, Eléonore; Linden, Anthony; Hounzangbe-Adote, Sylvie; Kouam, Siméon F.; Gbenou, Joachim D. Anthelmintic flavonoids and other compounds from Combretum glutinosum Perr. ex DC (Combretaceae) leaves Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 1760.12
Cell parameters: 4.97902; 18.5654; 19.1368; 89.5065; 84.322; 89.375;

COD ID: 2022413

Formula: - C30 H50 O3 -
Comments: Toklo, Placide M.; Yayi Ladekan, Eléonore; Linden, Anthony; Hounzangbe-Adote, Sylvie; Kouam, Siméon F.; Gbenou, Joachim D. Anthelmintic flavonoids and other compounds from Combretum glutinosum Perr. ex DC (Combretaceae) leaves Acta Crystallographica Section C 77(9) (2021)
Space group: P 21 21 21
Cell volume: 2615.55
Cell parameters: 6.37386; 12.10746; 33.8928; 90; 90; 90;

COD ID: 2022414

Formula: - C125 H116 K6 O8 Si6 -
Comments: Wytrych, Patrycja; Utko, Józef; Lis, Tadeusz; John, Łukasz Polyoxometalate-like structure of new potassium triphenylsiloxides: [K~6~(OSiPh~3~)~6~(C~3~H~7~OH)(H~2~O)]·2C~6~H~5~CH~3~ and [K~6~(OSiPh~3~)~6~(H~2~O)~2~] Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 5637.4
Cell parameters: 13.081; 14.96; 31.017; 82.52; 87.24; 69.51;

COD ID: 2022415

Formula: - C108 H94 K6 O8 Si6 -
Comments: Wytrych, Patrycja; Utko, Józef; Lis, Tadeusz; John, Łukasz Polyoxometalate-like structure of new potassium triphenylsiloxides: [K~6~(OSiPh~3~)~6~(C~3~H~7~OH)(H~2~O)]·2C~6~H~5~CH~3~ and [K~6~(OSiPh~3~)~6~(H~2~O)~2~] Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 4966.3
Cell parameters: 12.7633; 14.7076; 28.183; 89.61; 78.98; 73.26;

COD ID: 2022416
CIF file Original IUCr paper	Formula: - C21 H16 F3 N3 O - Comments: Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis Acta Crystallographica Section C 77(9) (2021) Space group: P 31 Cell volume: 1374.41 Cell parameters: 17.1109; 17.1109; 5.4205; 90; 90; 120;

COD ID: 2022417
CIF file Original IUCr paper	Formula: - C18 H17 F4 N3 O - Comments: Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis Acta Crystallographica Section C 77(9) (2021) Space group: P 1 21 1 Cell volume: 1711.38 Cell parameters: 7.9933; 24.1126; 9.1926; 90; 105.003; 90;

COD ID: 2022418
CIF file Original IUCr paper	Formula: - C22 H16 F3 N3 O - Comments: Wolińska, Ewa; Wysocki, Waldemar; Branowska, Danuta; Karczmarzyk, Zbigniew Synthesis and structures of three new pyridine-containing oxazoline ligands of complexes for asymmetric catalysis Acta Crystallographica Section C 77(9) (2021) Space group: P 1 21 1 Cell volume: 941.38 Cell parameters: 4.933; 10.9919; 17.4202; 90; 94.718; 90;

COD ID: 2022419

Formula: - C19 H32 -
Comments: Crittenden, Christopher M.; DiPasquale, Antonio G. Two crystallographic forms and the absolute structure of 5α,14α-androstane Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21 1
Cell volume: 3158.92
Cell parameters: 7.4417; 9.8831; 43.0002; 90; 92.742; 90;

COD ID: 2022420

Formula: - C57 H94 O -
Comments: Crittenden, Christopher M.; DiPasquale, Antonio G. Two crystallographic forms and the absolute structure of 5α,14α-androstane Acta Crystallographica Section C 77(9) (2021)
Space group: P 21 21 21
Cell volume: 4743.86
Cell parameters: 7.1699; 22.148; 29.8734; 90; 90; 90;

COD ID: 2022421

Formula: - C19 H32 -
Comments: Crittenden, Christopher M.; DiPasquale, Antonio G. Two crystallographic forms and the absolute structure of 5α,14α-androstane Acta Crystallographica Section C 77(9) (2021)
Space group: P 21 21 21
Cell volume: 4771.72
Cell parameters: 7.1465; 22.2064; 30.0679; 90; 90; 90;

COD ID: 2022422

Formula: - C40 H53 B Fe O S3 -
Comments: Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G. Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 1952.1
Cell parameters: 10.6835; 12.8042; 15.795; 77.614; 75.849; 70.332;

COD ID: 2022423

Formula: - C29 H47 B Fe O S3 -
Comments: Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G. Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart Acta Crystallographica Section C 77(9) (2021)
Space group: C 1 2/c 1
Cell volume: 6284.9
Cell parameters: 11.496; 15.036; 36.375; 90; 91.664; 90;

COD ID: 2022424

Formula: - C68 H102 B2 Fe2 O2 S6 -
Comments: Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G. Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 1778.5
Cell parameters: 10.359; 13.084; 13.98; 71.048; 87.964; 82.954;

COD ID: 2022425

Formula: - C42 H74 B2 Co2 O4 S6 -
Comments: Wang, Peng; Yap, Glenn P. A.; Riordan, Charles G. Iron(II)‒alkoxide and ‒aryloxide complexes of a tris(thioether)borate ligand: synthesis, molecular structures, and implications on the origin of instability of their iron(II)‒catecholate counterpart Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/n 1
Cell volume: 2564
Cell parameters: 14.409; 9.494; 18.745; 90; 90.938; 90;

COD ID: 2022426

Formula: - C26 H12 N4 -
Comments: Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 1897.5
Cell parameters: 7.3192; 8.2802; 31.3093; 90; 90.162; 90;

COD ID: 2022427

Formula: - C24 H10 F4 N2 -
Comments: Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 1838.1
Cell parameters: 15.4617; 7.0577; 16.9113; 90; 95.095; 90;

COD ID: 2022428

Formula: - C26 H10 F8 -
Comments: Wu, Pengfei; Zhou, Long; Xia, Shuwei; Yu, Liangmin Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21 1
Cell volume: 958
Cell parameters: 6.773; 14.323; 10.02; 90; 99.732; 90;

COD ID: 2022429

Formula: - C29 H32 N2 O6 -
Comments: Harris, Nehemiah; Benedict, Jubilee; Dickie, Diane A.; Pagola, Silvina Mechanochemical synthesis insights and solid-state characterization of quininium aspirinate, a glass-forming drug‒drug salt Acta Crystallographica Section C 77(9) (2021)
Space group: P 21 21 21
Cell volume: 2548.2
Cell parameters: 8.6256; 9.668; 30.557; 90; 90; 90;

COD ID: 2022430

Formula: - C24 H40 N4 O16 S2 -
Comments: Santana, Carlos L.; Reinheimer, Eric W.; Groeneman, Ryan H. Square network based upon the molecular salt of the tetraprotonated photoproduct rtct-tetrakis(pyridin-4-yl)cyclobutane and the sulfate anion Acta Crystallographica Section C 77(9) (2021)
Space group: C 1 2 1
Cell volume: 1533.53
Cell parameters: 9.7415; 16.3378; 9.6396; 90; 91.68; 90;

COD ID: 2022431

Formula: - C78 H126 N4 O7 Sb2 -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 7704
Cell parameters: 21.243; 18.997; 21.743; 90; 118.6; 90;

COD ID: 2022432

Formula: - C50 H70 Cl N4 Sb -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 4794.3
Cell parameters: 18.443; 20.455; 12.817; 90; 97.46; 90;

COD ID: 2022433

Formula: - C50 H70 Br N4 Sb -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 4957.7
Cell parameters: 18.7239; 20.5497; 12.9785; 90; 96.886; 90;

COD ID: 2022434

Formula: - C50 H70 I N4 Sb -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P 1 21/c 1
Cell volume: 4975.7
Cell parameters: 18.616; 20.713; 12.9942; 90; 96.75; 90;

COD ID: 2022435

Formula: - C25 H35 Br2 N2 Sb -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 1305.2
Cell parameters: 10.105; 10.332; 14.24; 96.69; 103.93; 111.72;

COD ID: 2022436

Formula: - C25 H35 I2 N2 Sb -
Comments: Al-Dabbagh, Areej; Guo, Zhifang; Junk, Peter; Wang, Jun Synthesis and characterization of a range of antimony(I/III) N,N'-bis(2,6-diisopropylphenyl)formamidinate complexes Acta Crystallographica Section C 77(9) (2021)
Space group: P -1
Cell volume: 1405.65
Cell parameters: 10.4137; 10.5559; 14.6097; 95.876; 104.946; 111.754;

COD ID: 2022438

Formula: - C9 H8 F4 I2 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/c 1
Cell volume: 1365.35
Cell parameters: 12.1701; 7.9283; 14.3228; 90; 98.898; 90;

COD ID: 2022439

Formula: - C7 H4 F4 I2 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P b c a
Cell volume: 2350.2
Cell parameters: 8.5853; 11.6911; 23.4148; 90; 90; 90;

COD ID: 2022440

Formula: - C9 H8 F4 I2 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P -1
Cell volume: 700.94
Cell parameters: 7.1432; 7.8452; 13.7688; 83.922; 76.598; 69.092;

COD ID: 2022441

Formula: - C10 H12 F4 I2 N2 O S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: C 1 2/c 1
Cell volume: 3209.6
Cell parameters: 19.3088; 7.3062; 22.8048; 90; 93.93; 90;

COD ID: 2022442

Formula: - C11 H14 F4 I2 N2 O S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: C 1 2/c 1
Cell volume: 3431.28
Cell parameters: 20.3027; 7.5161; 22.5373; 90; 93.872; 90;

COD ID: 2022443

Formula: - C9 H8 F4 I2 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: C 1 2/c 1
Cell volume: 2772.6
Cell parameters: 26.134; 7.4435; 14.732; 90; 104.65; 90;

COD ID: 2022444

Formula: - C9 H8 F3 I3 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P -1
Cell volume: 765.41
Cell parameters: 7.5014; 9.1065; 11.8534; 79.871; 83.011; 74.41;

COD ID: 2022445

Formula: - C5 H8 I4 N2 S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: C 1 2/c 1
Cell volume: 1357.93
Cell parameters: 22.3783; 4.32943; 14.67541; 90; 107.243; 90;

COD ID: 2022446

Formula: - C10 H14 I8 N2 O S -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P -1
Cell volume: 1273.99
Cell parameters: 7.7715; 12.3862; 14.129; 78.476; 79.61; 74.766;

COD ID: 2022447

Formula: - C14 H14 I14 N4 S2 -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/c 1
Cell volume: 1998
Cell parameters: 7.813; 30.677; 9.085; 90; 113.429; 90;

COD ID: 2022448

Formula: - C16 H24 I16 N8 S2 -
Comments: Peloquin, Andrew J.; Ragusa, Arianna C.; McMillen, Colin D.; Pennington, William T. The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/n 1
Cell volume: 2381.86
Cell parameters: 7.6879; 16.2822; 19.0763; 90; 94.074; 90;

COD ID: 2022449

Formula: - C15 H30 N3 S6 Sb -
Comments: Ng, Seik Weng Resolvable polymorphism in an intergrowth of two modifications of tris(diethyldithiocarbamato)antimony Acta Crystallographica Section C 77(10) (2021) 610-614
Space group: P -1
Cell volume: 2387.95
Cell parameters: 10.0692; 14.3797; 17.3124; 89.98; 80.578; 75.145;

COD ID: 2022450

Formula: - C15 H30 N3 S6 Sb -
Comments: Ng, Seik Weng Resolvable polymorphism in an intergrowth of two modifications of tris(diethyldithiocarbamato)antimony Acta Crystallographica Section C 77(10) (2021) 610-614
Space group: P 1 21/c 1
Cell volume: 2424.3
Cell parameters: 12.4204; 13.5117; 14.6614; 90; 99.832; 90;

COD ID: 2022451

Formula: - C16 H11 Gd N2 O10 -
Comments: Wei, Wen-Wen; Lu, Li-Ping; Feng, Si-Si; Zhu, Miao-Li; Englert, Ulli Synthesis, structure and magnetocaloric properties of a new two-dimensional gadolinium(III) coordination polymer based on azobenzene-2,2',3,3'-tetracarboxylic acid Acta Crystallographica Section C 77(10) (2021) 591-598
Space group: C 1 2/c 1
Cell volume: 1773.6
Cell parameters: 25.725; 5.0236; 17.274; 90; 127.393; 90;

COD ID: 2022452

Formula: - C11 H15 Cl N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: R 3 c :H
Cell volume: 5508.6
Cell parameters: 29.3337; 29.3337; 7.3922; 90; 90; 120;

COD ID: 2022453

Formula: - C17 H19 Cl N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/n 1
Cell volume: 6227.1
Cell parameters: 10.399; 16.3016; 37.091; 90; 97.963; 90;

COD ID: 2022454

Formula: - C11 H15 Cl N2 O -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/c 1
Cell volume: 1172.27
Cell parameters: 14.6858; 8.3613; 9.7878; 90; 102.742; 90;

COD ID: 2022455

Formula: - C10 H12 Br Cl N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P b c a
Cell volume: 2356.7
Cell parameters: 8.6153; 9.3766; 29.173; 90; 90; 90;

COD ID: 2022456

Formula: - C10 H12 Cl2 N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/c 1
Cell volume: 1142.42
Cell parameters: 14.703; 8.6058; 9.4141; 90; 106.45; 90;

COD ID: 2022457

Formula: - C10 H12 Cl F N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P b c a
Cell volume: 2153.28
Cell parameters: 8.6708; 9.6684; 25.6854; 90; 90; 90;

COD ID: 2022458

Formula: - C11 H15 Cl N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/c 1
Cell volume: 1147.73
Cell parameters: 14.9939; 8.427; 9.5388; 90; 107.774; 90;

COD ID: 2022459

Formula: - C10 H12 Cl F N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P b c a
Cell volume: 2108.86
Cell parameters: 8.3572; 10.3493; 24.3824; 90; 90; 90;

COD ID: 2022460

Formula: - C11 H15 Cl N2 -
Comments: Pham, Duyen N. K.; Belanger, Zachary S.; Chadeayne, Andrew R.; Golen, James A.; Manke, David R. The crystalline forms of nine hydrochloride salts of substituted tryptamines Acta Crystallographica Section C 77(10) (2021)
Space group: P b c a
Cell volume: 2358
Cell parameters: 9.1893; 9.3259; 27.5149; 90; 90; 90;

COD ID: 2022461

Formula: - C16 H13 N5 O2 -
Comments: Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Kennedy, Alan R. Synthesis, spectroscopic characterization, structural studies, thermal analysis and molecular docking of N-(2-methyl-5-nitrophenyl)-4-(pyridin-2-yl)pyrimidin-2-amine, a precursor for drug design against chronic myeloid leukemia Acta Crystallographica Section C 77(10) (2021)
Space group: P 1 21/n 1
Cell volume: 1370.85
Cell parameters: 8.0616; 17.8873; 9.5504; 90; 95.49; 90;

COD ID: 2022462

Formula: - C31.5 H29 Cl2 Cu N6 O6 -
Comments: Li, Xinhua; Niu, Mengyuan; Wang, Ai; Lu, Liping; Englert, Ulli; Feng, Sisi; Zhang, Lizhen; Yuan, Caixia Synthesis, structure and in vitro biological properties of a new copper(II) complex with 4-{[3-(pyridin-2-yl)-1H-pyrazol-1-yl]methyl}benzoic acid Acta Crystallographica Section C 77(10) (2021) 641-648
Space group: P -1
Cell volume: 1608.84
Cell parameters: 8.4226; 13.4978; 15.206; 74.26; 82.358; 75.781;

COD ID: 2022463

Formula: - C18 H16 N2 Se -
Comments: Korona-Głowniak, Izabela; Nitek, Wojciech; Tejchman, Waldemar; Żesławska, Ewa Influence of chlorine and methyl substituents and their position on the antimicrobial activities and crystal structures of 4-methyl-1,6-diphenylpyrimidine-2(1H)-selenone derivatives Acta Crystallographica Section C 77(10) (2021) 649-658
Space group: P 1 21/c 1
Cell volume: 1526.65
Cell parameters: 13.691; 11.2468; 10.3665; 90; 106.98; 90;

COD ID: 2022464

Formula: - C18 H16 N2 Se -
Comments: Korona-Głowniak, Izabela; Nitek, Wojciech; Tejchman, Waldemar; Żesławska, Ewa Influence of chlorine and methyl substituents and their position on the antimicrobial activities and crystal structures of 4-methyl-1,6-diphenylpyrimidine-2(1H)-selenone derivatives Acta Crystallographica Section C 77(10) (2021) 649-658
Space group: P 1 21/c 1
Cell volume: 1550.2
Cell parameters: 8.477; 19.618; 9.803; 90; 108.025; 90;

COD ID: 2022465

Formula: - C18 H16 N2 Se -
Comments: Korona-Głowniak, Izabela; Nitek, Wojciech; Tejchman, Waldemar; Żesławska, Ewa Influence of chlorine and methyl substituents and their position on the antimicrobial activities and crystal structures of 4-methyl-1,6-diphenylpyrimidine-2(1H)-selenone derivatives Acta Crystallographica Section C 77(10) (2021) 649-658
Space group: P 1 21/c 1
Cell volume: 1565.63
Cell parameters: 12.252; 12.293; 10.405; 90; 92.516; 90;

COD ID: 2022466

Formula: - C17 H13 Cl N2 Se -
Comments: Korona-Głowniak, Izabela; Nitek, Wojciech; Tejchman, Waldemar; Żesławska, Ewa Influence of chlorine and methyl substituents and their position on the antimicrobial activities and crystal structures of 4-methyl-1,6-diphenylpyrimidine-2(1H)-selenone derivatives Acta Crystallographica Section C 77(10) (2021) 649-658
Space group: P 1 21/c 1
Cell volume: 1572.58
Cell parameters: 13.778; 11.405; 10.402; 90; 105.828; 90;

COD ID: 2022467

Formula: - C13 H26 O12 -
Comments: Lin, Jieye; Oliver, Allen G.; Serianni, Anthony S. Methyl β-lactoside [methyl β-D-galactopyranosyl-(1\ρightarrow 4)-β-D-glucopyranoside] monohydrate: a solvomorphism study Acta Crystallographica Section C 77(10) (2021) 668-674
Space group: P 1 21 1
Cell volume: 819.64
Cell parameters: 4.625; 24.0147; 7.6617; 90; 105.595; 90;

COD ID: 2022468

Formula: - C21 H26 F N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P -1
Cell volume: 926.97
Cell parameters: 6.5324; 10.6141; 14.1675; 80.364; 81.094; 74.507;

COD ID: 2022469

Formula: - C21 H26 F N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P n a 21
Cell volume: 1821.35
Cell parameters: 12.2569; 8.9658; 16.5739; 90; 90; 90;

COD ID: 2022470

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1956.2
Cell parameters: 17.9412; 10.5067; 10.389; 90; 92.719; 90;

COD ID: 2022471

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1934.5
Cell parameters: 17.8739; 10.4846; 10.3312; 90; 92.296; 90;

COD ID: 2022472

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1913.9
Cell parameters: 17.8132; 10.4564; 10.2814; 90; 91.965; 90;

COD ID: 2022473

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1900.1
Cell parameters: 17.7326; 10.4696; 10.2385; 90; 91.536; 90;

COD ID: 2022474

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1880.41
Cell parameters: 17.3623; 10.6691; 10.1512; 90; 90.123; 90;

COD ID: 2022475

Formula: - C21 H26 Cl N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1869.6
Cell parameters: 17.3011; 10.678; 10.12; 90; 90.252; 90;

COD ID: 2022476

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1976.82
Cell parameters: 18.0356; 10.5891; 10.3641; 90; 92.894; 90;

COD ID: 2022477

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1954.79
Cell parameters: 17.9642; 10.5593; 10.3153; 90; 92.535; 90;

COD ID: 2022478

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1936.87
Cell parameters: 17.8944; 10.54749; 10.2693; 90; 92.1529; 90;

COD ID: 2022479

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1919.74
Cell parameters: 17.8028; 10.55679; 10.2191; 90; 91.695; 90;

COD ID: 2022480

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1901.27
Cell parameters: 17.5364; 10.65933; 10.1718; 90; 90.6047; 90;

COD ID: 2022481

Formula: - C21 H26 Br N O -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Selected solid-state behaviour of three di-tert-butyl-substituted N-salicylideneaniline derivatives: temperature-induced phase transitions and chromic behaviour Acta Crystallographica Section C 77(10) (2021) 659-667
Space group: P 1 21/c 1
Cell volume: 1893.58
Cell parameters: 17.445; 10.69412; 10.1501; 90; 90.1557; 90;

COD ID: 2022497

Formula: - C20 H16 N2 O3 -
Comments: Suganya, Suresh; Saravanan, Kandasamy; Jaganathan, Ramakrishnan; Kumaradhas, Poomani Salt formation, hydrogen-bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules Acta Crystallographica Section C 77(12) (2021) 790-799
Space group: P 21 21 21
Cell volume: 1747.8
Cell parameters: 7.1209; 12.1988; 20.1202; 90; 90; 90;

COD ID: 2022498

Formula: - C20 H14 Cl N O3 -
Comments: Suganya, Suresh; Saravanan, Kandasamy; Jaganathan, Ramakrishnan; Kumaradhas, Poomani Salt formation, hydrogen-bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules Acta Crystallographica Section C 77(12) (2021) 790-799
Space group: P 1 21/n 1
Cell volume: 1641.9
Cell parameters: 11.4959; 8.3756; 17.45; 90; 102.255; 90;

COD ID: 2022499

Formula: - C22 H20 N2 O4 -
Comments: Suganya, Suresh; Saravanan, Kandasamy; Jaganathan, Ramakrishnan; Kumaradhas, Poomani Salt formation, hydrogen-bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules Acta Crystallographica Section C 77(12) (2021) 790-799
Space group: P 1 21/c 1
Cell volume: 1880.6
Cell parameters: 7.3436; 11.0761; 23.123; 90; 90.835; 90;

COD ID: 2022500

Formula: - C6 H12 Co N2 O6 -
Comments: Dzesse T., Christelle N.; Majoumo-Mbe, Felicite; Nfor, Emmanuel N.; Bourne, Susan A. A homochiral coordination polymer of cobalt(II) and L-serine Acta Crystallographica Section C 77(12) (2021) 764-769
Space group: P 1 21 1
Cell volume: 469.01
Cell parameters: 5.5666; 8.7105; 9.8314; 90; 100.311; 90;

COD ID: 2022501

Formula: - C26 H20 Co N14 S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1404.22
Cell parameters: 8.4792; 10.1307; 16.3774; 90; 93.485; 90;

COD ID: 2022502

Formula: - C26 H20 Co N14 S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1368.07
Cell parameters: 11.4978; 9.5235; 12.7179; 90; 100.771; 90;

COD ID: 2022503

Formula: - C26 H20 N14 Ni S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1371.8
Cell parameters: 8.4041; 10.0681; 16.236; 90; 93.06; 90;

COD ID: 2022504

Formula: - C26 H20 N14 Ni S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1392.4
Cell parameters: 11.586; 9.5489; 12.8132; 90; 100.806; 90;

COD ID: 2022505

Formula: - C26 H20 Co N14 S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1436.1
Cell parameters: 8.487; 10.249; 16.539; 90; 93.419; 90;

COD ID: 2022506

Formula: - C26 H20 Co N14 S2 -
Comments: Mason, Helen E.; Howard, Judith A. K.; Sparkes, Hazel A. Co(NCS)~2~(abpt)~2~ and Ni(NCS)~2~(abpt)~2~ [abpt is 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Acta Crystallographica Section C 77(12) (2021) 777-781
Space group: P 1 21/n 1
Cell volume: 1400.48
Cell parameters: 11.5855; 9.5998; 12.8411; 90; 101.3; 90;

COD ID: 2022507

Formula: - C8 H10 B F2 N3 O -
Comments: Ośmiałowski, Borys; Dziuk, Błażej; Ejsmont, Krzysztof; Checińska, Lilianna; Dobrzańska, Liliana Effect of conjugated system extension on structural features and electron-density distribution in charge–transfer difluoroborates Acta Crystallographica Section C 77(12) (2021) 807-813
Space group: P -1
Cell volume: 462.62
Cell parameters: 7.7181; 8.2139; 8.7684; 79.847; 66.782; 64.907;

COD ID: 2022508

Formula: - C18 H18 B F2 N3 O -
Comments: Ośmiałowski, Borys; Dziuk, Błażej; Ejsmont, Krzysztof; Checińska, Lilianna; Dobrzańska, Liliana Effect of conjugated system extension on structural features and electron-density distribution in charge–transfer difluoroborates Acta Crystallographica Section C 77(12) (2021) 807-813
Space group: P -1
Cell volume: 821.83
Cell parameters: 8.1445; 8.2758; 12.7398; 93.518; 105.066; 95.613;

COD ID: 2022509

Formula: - C11 H11 Cl Mn N6 O4 -
Comments: Zhao, Dan; An, Yanyan; Guo, Tingting; Yan, Juanzhi; Song, Danmei A three-dimensional manganese(II) coordination polymer with two functional properties: magnetism and photochemical detection Acta Crystallographica Section C 77(12) (2021) 782-789
Space group: P 1 21/c 1
Cell volume: 1426.4
Cell parameters: 11.0241; 18.827; 6.881; 90; 92.816; 90;

COD ID: 2022510

Formula: - C11 H17 Cd N O7 -
Comments: Liu, Yan; Zhang, Hong-Tao A new two-dimensional folding sheet-like coordination polymer assembled from cadmium(II) and (S)-2-(benzylamino)succinic acid: synthesis, structure and properties Acta Crystallographica Section C 77(12) (2021) 770-776
Space group: P 1 21 1
Cell volume: 676.4
Cell parameters: 5.8737; 8.3842; 13.788; 90; 95.025; 90;

COD ID: 2022511

Formula: - C19 H15 N3 O -
Comments: Trivedi, Laxmikant; Gupta, Kratika; Mishra, Vipin; Gopakumar, Thiruvancheril G.; Gupta, Atul; Vasudev, Prema G. Crystal structure and self-assembly on graphite of a pyrazolo[1,5-c]pyrimidine derivative Acta Crystallographica Section C 77(12) (2021) 757-763
Space group: P 1 21/c 1
Cell volume: 3029.6
Cell parameters: 5.7626; 36.693; 14.3279; 90; 90.07; 90;

COD ID: 2022567

Formula: - C22 H21 Br N6 O2 S -
Comments: Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C 77(11) (2021) 698-706
Space group: P 1 21/c 1
Cell volume: 2449.3
Cell parameters: 9.2801; 15.433; 17.1702; 90; 95.116; 90;

COD ID: 2022568

Formula: - C22 H21 Br N6 O2 S -
Comments: Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C 77(11) (2021) 698-706
Space group: P -1
Cell volume: 1184.87
Cell parameters: 8.6953; 9.3336; 15.1494; 96.181; 102.323; 95.632;

COD ID: 2022569

Formula: - C24 H24 Br N7 O2 -
Comments: Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C 77(11) (2021) 698-706
Space group: P -1
Cell volume: 1268.67
Cell parameters: 8.8344; 11.2114; 13.3205; 100.065; 98.949; 96.828;

COD ID: 2022570

Formula: - C23 H21 Br N6 O2.5 -
Comments: Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C 77(11) (2021) 698-706
Space group: P 1 21/c 1
Cell volume: 4631.22
Cell parameters: 8.7721; 22.3659; 23.6458; 90; 93.364; 90;

COD ID: 2022571

Formula: - C21 H16 Br N6 O3 -
Comments: Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C 77(11) (2021) 698-706
Space group: I 1 2/a 1
Cell volume: 4165.3
Cell parameters: 15.5664; 15.3769; 18.4445; 90; 109.359; 90;

COD ID: 2022572

Formula: - C28 H38 Cd2 N4 O17 -
Comments: Zhang, Hong-Tao; Wang, Xiao-Long A new three-dimensional twofold interpenetrated cadmium(II) metal–organic framework: synthesis, structure and photoluminescence properties Acta Crystallographica Section C 77(11) (2021) 691-697
Space group: P 21 21 21
Cell volume: 3428
Cell parameters: 13.8013; 14.5077; 17.1208; 90; 90; 90;

COD ID: 2022573

Formula: - C18 H30 Ba Ca2 O12 -
Comments: Fábry, Jan; Dušek, Michal Low-temperature phases of dicalcium barium hexakis(propanoate) Acta Crystallographica Section C 77(11) (2021) 683-690
Space group: P n m a
Cell volume: 2899
Cell parameters: 12.4158; 12.7108; 18.3698; 90; 90; 90;

COD ID: 2022574

Formula: - C18 H30 Ba Ca2 O12 -
Comments: Fábry, Jan; Dušek, Michal Low-temperature phases of dicalcium barium hexakis(propanoate) Acta Crystallographica Section C 77(11) (2021) 683-690
Space group: P 21 21 21
Cell volume: 2816.1
Cell parameters: 12.3585; 12.6; 18.0846; 90; 90; 90;

COD ID: 2022575

Formula: - C46 H56 Fe N4 P2 Se2 -
Comments: Kunchur, Harish S.; Mondal, Dipanjan; Rao, Sowmya; Mague, Joel T.; Balakrishna, Maravanji S. Synthesis, structural, characterization and Hirshfeld analysis of a bisselenide and a zinc complex of a new hemilabile ferrocenylbisphosphane, [Fe{C~5~H~4~P(C~6~H~4~CH~2~NMe~2~-o)~2~}~2~] Acta Crystallographica Section C 77(11) (2021) 725-733
Space group: P -1
Cell volume: 1047.2
Cell parameters: 9.244; 10.465; 10.998; 93.969; 97.973; 94.312;

COD ID: 2022576

Formula: - C47 H58 Cl6 Fe N4 P2 Zn2 -
Comments: Kunchur, Harish S.; Mondal, Dipanjan; Rao, Sowmya; Mague, Joel T.; Balakrishna, Maravanji S. Synthesis, structural, characterization and Hirshfeld analysis of a bisselenide and a zinc complex of a new hemilabile ferrocenylbisphosphane, [Fe{C~5~H~4~P(C~6~H~4~CH~2~NMe~2~-o)~2~}~2~] Acta Crystallographica Section C 77(11) (2021) 725-733
Space group: P -1
Cell volume: 2564.4
Cell parameters: 10.115; 10.7515; 26.637; 96.791; 91.486; 116.491;

COD ID: 2022577

Formula: - C28 H28 Mn N2 O12 -
Comments: Jiao, Yuan; Jin, Fu-Ning; Feng, Si-Si; Wang, Ai; Englert, Ulli Synthesis, crystal structure and magnetic properties of a one-dimensional Mn^2+^ complex constructed from (+)-dibenzoyltartaric acid and 2,2'-bipyridine Acta Crystallographica Section C 77(11) (2021) 707-712
Space group: P 21 21 21
Cell volume: 2947.7
Cell parameters: 7.86; 16.233; 23.103; 90; 90; 90;

COD ID: 2022578

Formula: - C29 H24 Cd N4 O4 -
Comments: Chen, Hui-Ru A cadmium(II) coordination polymer with a fivefold interpenetrating diamondoid three-dimensional framework: synthesis, crystal structure, luminescence and photocatalytic properties Acta Crystallographica Section C 77(11) (2021) 734-739
Space group: P 21 21 21
Cell volume: 2632.8
Cell parameters: 14.438; 8.555; 21.315; 90; 90; 90;

COD ID: 2312027

Formula: - C12 H16 Ca N2 O9 -
Comments: Liu, Huang Huang; Liang, Chu Heng; Liu, Yan; Zhang, Hong Tao A two-dimensional calcium (II) coordination polymer constructed from 2,2'-[terephthaloylbis(azanediyl)]diacetate: synthesis, structure and properties. Acta crystallographica. Section C, Structural chemistry 77(Pt 11) (2021) 675-682
Space group: P -1
Cell volume: 780.3
Cell parameters: 6.661; 9.833; 12.612; 74.277; 79.224; 84.609;

COD ID: 2312347

Formula: - C30 H26 Cl3 N O4 -
Comments: Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry 77(Pt 12) (2021) 745-756
Space group: P 1 21 1
Cell volume: 1397.15
Cell parameters: 10.0732; 10.0051; 14.7474; 90; 109.945; 90;

COD ID: 2312348

Formula: - C30 H27 Cl2 N O4 -
Comments: Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry 77(Pt 12) (2021) 745-756
Space group: P 1 21 1
Cell volume: 1364.05
Cell parameters: 10.04475; 9.82563; 14.59465; 90; 108.742; 90;

COD ID: 2312349

Formula: - C30 H26 Cl3 N O4 -
Comments: Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry 77(Pt 12) (2021) 745-756
Space group: P 21 21 2
Cell volume: 2991.44
Cell parameters: 9.27898; 32.3574; 9.96336; 90; 90; 90;

COD ID: 2312350

Formula: - C29.1 H25.2 Cl0.2 N O4 -
Comments: Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry 77(Pt 12) (2021) 745-756
Space group: P 21 21 21
Cell volume: 2338.95
Cell parameters: 9.28862; 10.34013; 24.3525; 90; 90; 90;

COD ID: 2312351