Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section C' volume of publication is 66

COD ID: 2017461
CIF file

HKL data

Original IUCr paper

Formula: - Co1.97 Li4.03 O14 P4 -
Comments: Kouass, Salah; Guesmi, Abderrahmen; Driss, Ahmed Le phosphate de cobalt et de lithium à valence mixte Li~4+<i>x~</i>Co~2{-~<i>x</i>}(P~2~O~7~)~2~ (<i>x</i> = 0,03): étude structurale et analyse de distribution de charge Acta Crystallographica Section C 66(1) (2010) i4-i6
Space group: P 1 21/a 1
Cell volume: 1030.9
Cell parameters: 9.817; 9.741; 11.012; 90; 101.76; 90;  

COD ID: 2017462
CIF file

HKL data

Original IUCr paper

Formula: - C5 H13 K N2 O9 P2 -
Comments: Freire, Eleonora; Vega, Daniel R.; Baggio, Ricardo Zoledronate complexes. I. Poly[[μ~2~-aqua[μ~3~-1-hydroxy-2-(1<i>H</i>,3<i>H</i>-imidazol-3-ium-1-yl)ethylidenediphosphonato]potassium(I)] monohydrate] Acta Crystallographica Section C 66(1) (2010) m13-m16
Space group: P -1
Cell volume: 630.3
Cell parameters: 6.961; 7.038; 13.322; 94.82; 103.75; 92.58;  

COD ID: 2017463
CIF file

Original IUCr paper

Formula: - C9 H12 Cl N3 O4 -
Comments: Brüning, Jürgen; Peters, Alexander; Bats, Jan W.; Schmidt, Martin U. 7-Methoxy-2,3-dioxo-1,4-dihydroquinoxalin-6-aminium chloride monohydrate Acta Crystallographica Section C 66(1) (2010) o1-o4
Space group: P b c a
Cell volume: 2221.6
Cell parameters: 6.7339; 15.469; 21.327; 90; 90; 90;  

COD ID: 2017464
CIF file

HKL data

Original IUCr paper

Formula: - C13 H26 N2 O13 -
Comments: Katagiri, Hiroshi; Morimoto, Masao; Sakai, Kenichi A pair of diastereomeric 1:2 salts of (<i>R</i>)- and (<i>S</i>)-2-methylpiperazine with (2<i>S</i>,3<i>S</i>)-tartaric acid Acta Crystallographica Section C 66(1) (2010) o20-o24
Space group: P 21 21 21
Cell volume: 1756.3
Cell parameters: 7.5571; 7.7903; 29.8324; 90; 90; 90;  

COD ID: 2017465
CIF file

HKL data

Original IUCr paper

Formula: - C13 H26 N2 O13 -
Comments: Katagiri, Hiroshi; Morimoto, Masao; Sakai, Kenichi A pair of diastereomeric 1:2 salts of (<i>R</i>)- and (<i>S</i>)-2-methylpiperazine with (2<i>S</i>,3<i>S</i>)-tartaric acid Acta Crystallographica Section C 66(1) (2010) o20-o24
Space group: P 21 21 21
Cell volume: 1767.11
Cell parameters: 7.6062; 7.6426; 30.3987; 90; 90; 90;  

COD ID: 2017466
CIF file

HKL data

Original IUCr paper

Formula: - C15 H15 N3 O2 -
Comments: Quiroga, Jairo; Portilla, Jaime; Cobo, Justo; Glidewell, Christopher A simple hydrogen-bonded chain in (3<i>Z</i>)-3-{1-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3<i>H</i>)-one, and a hydrogen-bonded ribbon of centrosymmetric rings in the self-assembled adduct (3<i>Z</i>)-3-{1-[(5-methyl-1<i>H</i>-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3<i>H</i>)-one‒6-(2-hydroxyethyl)-2,5-dimethylpyrazolo[1,5-<i>a</i>]pyrimidin-7(4<i>H</i>)-one (1/1) Acta Crystallographica Section C 66(1) (2010) o25-o28
Space group: P 1 21/c 1
Cell volume: 1291.6
Cell parameters: 10.4969; 9.855; 12.6739; 90; 99.883; 90;  

COD ID: 2017467
CIF file

HKL data

Original IUCr paper

Formula: - C20 H26 N6 O4 -
Comments: Quiroga, Jairo; Portilla, Jaime; Cobo, Justo; Glidewell, Christopher A simple hydrogen-bonded chain in (3<i>Z</i>)-3-{1-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3<i>H</i>)-one, and a hydrogen-bonded ribbon of centrosymmetric rings in the self-assembled adduct (3<i>Z</i>)-3-{1-[(5-methyl-1<i>H</i>-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3<i>H</i>)-one‒6-(2-hydroxyethyl)-2,5-dimethylpyrazolo[1,5-<i>a</i>]pyrimidin-7(4<i>H</i>)-one (1/1) Acta Crystallographica Section C 66(1) (2010) o25-o28
Space group: P -1
Cell volume: 982.7
Cell parameters: 8.0402; 8.2025; 15.348; 91.999; 99.785; 99.172;  

COD ID: 2017468
CIF file

HKL data

Original IUCr paper

Formula: - C18 H19 N5 O3 -
Comments: Quiroga, Jairo; Gálvez, Jaime; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher 2-Cyano-<i>N</i>-(2,6-dimethoxypyrimidin-4-yl)-3-[4-(dimethylamino)phenyl]acrylamide and dimethylammonium 6-cyano-1,3-dimethyl-2,4,5-trioxo-1,2,3,4,5,8-hexahydropyrido[2,3-<i>d</i>]pyrimidin-8-ide: a π-stacked dimer and a hydrogen-bonded ribbon containing three types of ring Acta Crystallographica Section C 66(1) (2010) o39-o43
Space group: P -1
Cell volume: 849.8
Cell parameters: 7.9772; 10.0023; 10.8409; 93.693; 93.562; 99.196;  

COD ID: 2017469
CIF file

HKL data

Original IUCr paper

Formula: - C12 H15 N5 O3 -
Comments: Quiroga, Jairo; Gálvez, Jaime; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher 2-Cyano-<i>N</i>-(2,6-dimethoxypyrimidin-4-yl)-3-[4-(dimethylamino)phenyl]acrylamide and dimethylammonium 6-cyano-1,3-dimethyl-2,4,5-trioxo-1,2,3,4,5,8-hexahydropyrido[2,3-<i>d</i>]pyrimidin-8-ide: a π-stacked dimer and a hydrogen-bonded ribbon containing three types of ring Acta Crystallographica Section C 66(1) (2010) o39-o43
Space group: P -1
Cell volume: 650.69
Cell parameters: 8.152; 9.2984; 9.7299; 69.609; 70.741; 79.447;  

COD ID: 2017470
CIF file

HKL data

Original IUCr paper

Formula: - C6 H6 F6 Mn N2 O6 S2 -
Comments: Lutz, Martin; Schreurs, Antoine M. M.; Spek, Anthony L.; Moelands, Marcel A. H.; Klein Gebbink, Robertus J. M. <i>catena</i>-Poly[[bis(acetonitrile-κ<i>N</i>)manganese(II)]-bis(μ-trifluoromethanesulfonato-κ^2^<i>O</i>:<i>O</i>')] Acta Crystallographica Section C 66(1) (2010) m9-m12
Space group: P -1
Cell volume: 372.346
Cell parameters: 5.13763; 8.1188; 9.75293; 73.126; 76.885; 76.025;  

COD ID: 2017471
CIF file

HKL data

Original IUCr paper

Formula: - B14 Ba7 F5 K Mg2 O28 -
Comments: Li, R. K.; Chen, Peng KBa~7~Mg~2~B~14~O~28~F~5~, a new borate with an unusual heptaborate group and double perovskite unit Acta Crystallographica Section C 66(1) (2010) i7-i8
Space group: C 1 2/c 1
Cell volume: 2943.2
Cell parameters: 16.638; 13.609; 15.214; 90; 121.309; 90;  

COD ID: 2017472
CIF file

HKL data

Original IUCr paper

Formula: - C28 H18 N2 O2 -
Comments: Fourati, M. Amine; Maris, Thierry; Bazuin, C. Géraldine; Prud'homme, Robert E. (<i>E</i>)-4,4'-Bis(1,3-benzoxazol-2-yl)stilbene at 150 and 375K Acta Crystallographica Section C 66(1) (2010) o11-o14
Space group: C 1 2/c 1
Cell volume: 1950.72
Cell parameters: 11.2449; 6.0053; 29.0699; 90; 96.428; 90;  

COD ID: 2017473
CIF file

HKL data

Original IUCr paper

Formula: - C28 H18 N2 O2 -
Comments: Fourati, M. Amine; Maris, Thierry; Bazuin, C. Géraldine; Prud'homme, Robert E. (<i>E</i>)-4,4'-Bis(1,3-benzoxazol-2-yl)stilbene at 150 and 375K Acta Crystallographica Section C 66(1) (2010) o11-o14
Space group: C 1 2/c 1
Cell volume: 2028.08
Cell parameters: 11.3459; 6.0578; 29.6234; 90; 95.073; 90;  

COD ID: 2017474
CIF file

HKL data

Original IUCr paper

Formula: - C11 H12 N3 O1.5 -
Comments: Quiroga, Jairo; Trilleras, Jorge; Cobo, Justo; Glidewell, Christopher 5-Amino-3-methyl-1-phenyl-1<i>H</i>-pyrazole-4-carbaldehyde hemihydrate: a polarized electronic structure within hydrogen-bonded sheets of <i>R</i>~10~^8^(34) rings Acta Crystallographica Section C 66(1) (2010) o47-o49
Space group: P b c n
Cell volume: 1999.4
Cell parameters: 10.8346; 7.4952; 24.621; 90; 90; 90;  

COD ID: 2017475
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 O -
Comments: Bakowicz, Julia; Turowska-Tyrk, Ilona Monitoring structural transformations in crystals. 13. On photocyclization in 2,3,4,5,6-pentamethylbenzophenone, 1,3-diphenylbutan-1-one and 2,4,6-triisopropyl-4'-methoxybenzophenone Acta Crystallographica Section C 66(1) (2010) o29-o32
Space group: P 1 21/n 1
Cell volume: 1458.1
Cell parameters: 6.3784; 12.793; 18.014; 90; 97.28; 90;  

COD ID: 2017476
CIF file

HKL data

Original IUCr paper

Formula: - C16 H16 O -
Comments: Bakowicz, Julia; Turowska-Tyrk, Ilona Monitoring structural transformations in crystals. 13. On photocyclization in 2,3,4,5,6-pentamethylbenzophenone, 1,3-diphenylbutan-1-one and 2,4,6-triisopropyl-4'-methoxybenzophenone Acta Crystallographica Section C 66(1) (2010) o29-o32
Space group: P c a 21
Cell volume: 1261.4
Cell parameters: 10.7926; 14.931; 7.8275; 90; 90; 90;  

COD ID: 2017477
CIF file

HKL data

Original IUCr paper

Formula: - C23 H30 O2 -
Comments: Bakowicz, Julia; Turowska-Tyrk, Ilona Monitoring structural transformations in crystals. 13. On photocyclization in 2,3,4,5,6-pentamethylbenzophenone, 1,3-diphenylbutan-1-one and 2,4,6-triisopropyl-4'-methoxybenzophenone Acta Crystallographica Section C 66(1) (2010) o29-o32
Space group: P 1 21/c 1
Cell volume: 2093.7
Cell parameters: 9.2288; 12.0541; 18.821; 90; 90.021; 90;  

COD ID: 2017478
CIF file

HKL data

Original IUCr paper

Formula: - C11 H16 N2 O3 -
Comments: Gelbrich, Thomas; Zencirci, Neslihan; Griesser, Ulrich J. Hydrogen-bond motifs in <i>N</i>-monosubstituted derivatives of barbituric acid: 5-allyl-5-isopropyl-1-methylbarbituric acid (enallylpropymal) and 1,5-di(but-2-enyl)-5-ethylbarbituric acid Acta Crystallographica Section C 66(1) (2010) o55-o58
Space group: P -1
Cell volume: 573.51
Cell parameters: 6.416; 7.9559; 11.9569; 77.574; 80.837; 75.518;  

COD ID: 2017479
CIF file

HKL data

Original IUCr paper

Formula: - C14 H20 N2 O3 -
Comments: Gelbrich, Thomas; Zencirci, Neslihan; Griesser, Ulrich J. Hydrogen-bond motifs in <i>N</i>-monosubstituted derivatives of barbituric acid: 5-allyl-5-isopropyl-1-methylbarbituric acid (enallylpropymal) and 1,5-di(but-2-enyl)-5-ethylbarbituric acid Acta Crystallographica Section C 66(1) (2010) o55-o58
Space group: P 1 21/n 1
Cell volume: 1419.5
Cell parameters: 10.2825; 13.2972; 10.3959; 90; 92.999; 90;  

COD ID: 2017480
CIF file

HKL data

Original IUCr paper

Formula: - C17 H15 N3 S2 -
Comments: Rotondo, Archimede; Bruno, Giuseppe; Nicoló, Francesco; Tresoldi, Giuseppe; Di Pietro, Santo Dithioether ligands containing a 2,6-disubstituted pyridine linker with two thioether-heterocycle arms Acta Crystallographica Section C 66(1) (2010) o15-o19
Space group: P 1 21/c 1
Cell volume: 1557.7
Cell parameters: 10.696; 9.281; 16.741; 90; 110.39; 90;  

COD ID: 2017481
CIF file

HKL data

Original IUCr paper

Formula: - C19 H19 N3 S2 -
Comments: Rotondo, Archimede; Bruno, Giuseppe; Nicoló, Francesco; Tresoldi, Giuseppe; Di Pietro, Santo Dithioether ligands containing a 2,6-disubstituted pyridine linker with two thioether-heterocycle arms Acta Crystallographica Section C 66(1) (2010) o15-o19
Space group: P -1
Cell volume: 884.06
Cell parameters: 7.946; 9.842; 12.503; 69.829; 75.053; 80.807;  

COD ID: 2017482
CIF file

HKL data

Original IUCr paper

Formula: - C19.5 H23 N5 S2 -
Comments: Rotondo, Archimede; Bruno, Giuseppe; Nicoló, Francesco; Tresoldi, Giuseppe; Di Pietro, Santo Dithioether ligands containing a 2,6-disubstituted pyridine linker with two thioether-heterocycle arms Acta Crystallographica Section C 66(1) (2010) o15-o19
Space group: P -1
Cell volume: 990.56
Cell parameters: 7.407; 11.1; 12.428; 95.91; 99.8; 97.31;  

COD ID: 2017483
CIF file

HKL data

Original IUCr paper

Formula: - C22 H25 N3 O5 -
Comments: Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N. Multicomponent crystals of erlotinib Acta Crystallographica Section C 66(1) (2010) o33-o38
Space group: P -1
Cell volume: 1041.1
Cell parameters: 9.0227; 10.4548; 13.2014; 98.705; 108.738; 111.873;  

COD ID: 2017484
CIF file

HKL data

Original IUCr paper

Formula: - C46 H48 N6 O12 -
Comments: Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N. Multicomponent crystals of erlotinib Acta Crystallographica Section C 66(1) (2010) o33-o38
Space group: P -1
Cell volume: 1072.62
Cell parameters: 7.6285; 10.2252; 14.6525; 86.076; 84.925; 70.559;  

COD ID: 2017485
CIF file

HKL data

Original IUCr paper

Formula: - C24 H29 N3 O8 -
Comments: Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N. Multicomponent crystals of erlotinib Acta Crystallographica Section C 66(1) (2010) o33-o38
Space group: P -1
Cell volume: 1240.9
Cell parameters: 7.967; 13.248; 13.745; 108.916; 106.673; 101.909;  

COD ID: 2017486
CIF file

HKL data

Original IUCr paper

Formula: - C9 H16 N2 O8 -
Comments: Smith, Graham; Wermuth, Urs D. Three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of <small>L</small>-tartaric acid with the associative-group monosubstituted pyridines 3-aminopyridine, 3-carboxypyridine (nicotinic acid) and 2-carboxypyridine (picolinic acid) Acta Crystallographica Section C 66(1) (2010) o5-o10
Space group: P 21 21 21
Cell volume: 1286.4
Cell parameters: 7.3073; 12.1065; 14.541; 90; 90; 90;  

COD ID: 2017487
CIF file

HKL data

Original IUCr paper

Formula: - C10 H11 N O8 -
Comments: Smith, Graham; Wermuth, Urs D. Three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of <small>L</small>-tartaric acid with the associative-group monosubstituted pyridines 3-aminopyridine, 3-carboxypyridine (nicotinic acid) and 2-carboxypyridine (picolinic acid) Acta Crystallographica Section C 66(1) (2010) o5-o10
Space group: P 21 21 21
Cell volume: 1107.54
Cell parameters: 6.5792; 7.7637; 21.683; 90; 90; 90;  

COD ID: 2017488
CIF file

HKL data

Original IUCr paper

Formula: - C10 H13 N O9 -
Comments: Smith, Graham; Wermuth, Urs D. Three-dimensional hydrogen-bonded structures in the 1:1 proton-transfer compounds of <small>L</small>-tartaric acid with the associative-group monosubstituted pyridines 3-aminopyridine, 3-carboxypyridine (nicotinic acid) and 2-carboxypyridine (picolinic acid) Acta Crystallographica Section C 66(1) (2010) o5-o10
Space group: P 21 21 21
Cell volume: 1232.67
Cell parameters: 7.1536; 7.8273; 22.0145; 90; 90; 90;  

COD ID: 2017489
CIF file

HKL data

Original IUCr paper

Formula: - C19 H14 N2 O4 -
Comments: Abonía, Rodrigo; Cuervo, Paola; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher 1-(6-Amino-1,3-benzodioxol-5-yl)-3-(2-oxo-1,2-dihydroquinolin-3-yl)prop-2-enone: a sheet built by π-stacking of hydrogen-bonded chains of rings Acta Crystallographica Section C 66(1) (2010) o44-o46
Space group: P -1
Cell volume: 728.13
Cell parameters: 5.7799; 9.9485; 13.0849; 83.343; 86.652; 77.128;  

COD ID: 2017490
CIF file

HKL data

Original IUCr paper

Formula: - C36 H79 Au5 Cl20 N4 O19 -
Comments: Wood, Matthew R.; Thompson, Hugh W.; Brettell, Thomas A.; Lalancette, Roger A. The hydrated and anhydrous gold(III) tetrachloride salts of <small>L</small>-ecgonine, an important forensic toxicology marker for cocaine Acta Crystallographica Section C 66(1) (2010) m4-m8
Space group: P 21 21 21
Cell volume: 7267
Cell parameters: 9.2153; 15.299; 51.544; 90; 90; 90;  

COD ID: 2017491
CIF file

HKL data

Original IUCr paper

Formula: - C9 H16 Au Cl4 N O3 -
Comments: Wood, Matthew R.; Thompson, Hugh W.; Brettell, Thomas A.; Lalancette, Roger A. The hydrated and anhydrous gold(III) tetrachloride salts of <small>L</small>-ecgonine, an important forensic toxicology marker for cocaine Acta Crystallographica Section C 66(1) (2010) m4-m8
Space group: P 21 21 21
Cell volume: 2941.15
Cell parameters: 10.0276; 15.7339; 18.6416; 90; 90; 90;  

COD ID: 2017492
CIF file

HKL data

Original IUCr paper

Formula: - B10 H21 N2 O1.5 -
Comments: Yisgedu, Teshome B.; Chen, Xuenian; Lingam, Hima K.; Huang, Zhenguo; Meyers, Edward A.; Shore, Sheldon G.; Zhao, Ji-Cheng Intermolecular dihydrogen- and hydrogen-bonding interactions in diammonium <i>closo</i>-decahydrodecaborate sesquihydrate Acta Crystallographica Section C 66(1) (2010) m1-m3
Space group: P 1 21/n 1
Cell volume: 2318.6
Cell parameters: 11.674; 8.623; 23.318; 90; 98.97; 90;  

COD ID: 2017493
CIF file

HKL data

Original IUCr paper

Formula: - B2 Cd F K O6 Zn2 -
Comments: Zhang, Fan; Jiao, Zhi-Wei; Shen, De-Zhong; Shen, Guang-Qiu; Wang, Xiao-Qing CdZn~2~KB~2~O~6~F, a new fluoride borate crystal Acta Crystallographica Section C 66(1) (2010) i1-i3
Space group: P -3 1 c
Cell volume: 333.13
Cell parameters: 5.0381; 5.0381; 15.155; 90; 90; 120;  

COD ID: 2017494
CIF file

Original IUCr paper

Formula: - C25 H19 N2 P -
Comments: De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes Acta Crystallographica Section C 66(1) (2010) o50-o54
Space group: P 1 21/c 1
Cell volume: 1977
Cell parameters: 8.581; 13.862; 17.17; 90; 104.53; 90;  

COD ID: 2017495
CIF file

HKL data

Original IUCr paper

Formula: - C24 H19 N2 O2 P -
Comments: De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes Acta Crystallographica Section C 66(1) (2010) o50-o54
Space group: P 1 21/c 1
Cell volume: 2018.7
Cell parameters: 9.118; 17.536; 14.245; 90; 117.591; 90;  

COD ID: 2017496
CIF file

HKL data

Original IUCr paper

Formula: - C24 H19 N2 O2 P -
Comments: De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes Acta Crystallographica Section C 66(1) (2010) o50-o54
Space group: P -1
Cell volume: 1018.3
Cell parameters: 9.001; 9.77; 12.098; 84.34; 78.19; 78.41;  

COD ID: 2017497
CIF file

HKL data

Original IUCr paper

Formula: - C18 H24 N4 O -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Granisetron, an antiemetic drug, and its cobalt complex Acta Crystallographica Section C 66(2) (2010) m35-m39
Space group: P b c a
Cell volume: 3357.2
Cell parameters: 13.793; 13.5544; 17.9574; 90; 90; 90;  

COD ID: 2017498
CIF file

HKL data

Original IUCr paper

Formula: - C36 H78 Cl4 Co N8 O16 -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Granisetron, an antiemetic drug, and its cobalt complex Acta Crystallographica Section C 66(2) (2010) m35-m39
Space group: P -1
Cell volume: 1299.5
Cell parameters: 9.6311; 9.9794; 16.0133; 92.611; 103.449; 118.037;  

COD ID: 2017499
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 N4 O3 S -
Comments: Potočňák, Ivan; Imrich, Ján; Danihel, Ivan; Kožíšek, Jozef; Klika, Karel Douglas 4-(9,10-Dihydroacridin-9-ylidene)thiosemicarbazide and its five-membered thiazole and six-membered thiazine derivatives Acta Crystallographica Section C 66(2) (2010) o87-o92
Space group: P -1
Cell volume: 917.9
Cell parameters: 9.059; 10.238; 10.983; 74.18; 76.324; 71.74;  

COD ID: 2017500
CIF file

HKL data

Original IUCr paper

Formula: - C18 H14 N4 O S -
Comments: Potočňák, Ivan; Imrich, Ján; Danihel, Ivan; Kožíšek, Jozef; Klika, Karel Douglas 4-(9,10-Dihydroacridin-9-ylidene)thiosemicarbazide and its five-membered thiazole and six-membered thiazine derivatives Acta Crystallographica Section C 66(2) (2010) o87-o92
Space group: P 1 21 1
Cell volume: 774.26
Cell parameters: 4.7035; 18.5073; 9.1172; 90; 102.689; 90;  

COD ID: 2017501
CIF file

HKL data

Original IUCr paper

Formula: - C14 H12 N4 S -
Comments: Potočňák, Ivan; Imrich, Ján; Danihel, Ivan; Kožíšek, Jozef; Klika, Karel Douglas 4-(9,10-Dihydroacridin-9-ylidene)thiosemicarbazide and its five-membered thiazole and six-membered thiazine derivatives Acta Crystallographica Section C 66(2) (2010) o87-o92
Space group: P 1 21/c 1
Cell volume: 1246.75
Cell parameters: 8.6535; 18.6374; 7.835; 90; 99.372; 90;  

COD ID: 2017502
CIF file

HKL data

Original IUCr paper

Formula: - C14 H4 N2 O8 Pb2 -
Comments: Zhou, Su-Ping; Wu, Xu-Xian; Zu, Chao; Chen, Zi-Lu; Liang, Fu-Pei Poly[μ~8~-4,4'-bipyridine-2,2',6,6'-tetracarboxylato-dilead(II)] Acta Crystallographica Section C 66(2) (2010) m26-m28
Space group: C 1 2/c 1
Cell volume: 1456.1
Cell parameters: 19.696; 5.3916; 14.209; 90; 105.203; 90;  

COD ID: 2017503
CIF file

HKL data

Original IUCr paper

Formula: - C2 H5 N5 -
Comments: Lyakhov, Alexander S.; Voitekhovich, Sergei V.; Ivashkevich, Ludmila S.; Gaponik, Pavel N. A tetrazol-5-yl analogue of glycine, 5-ammoniomethyl-1<i>H</i>-tetrazolide, and its copper(II) complex Acta Crystallographica Section C 66(2) (2010) m22-m25
Space group: P 31
Cell volume: 318.87
Cell parameters: 7.3048; 7.3048; 6.9003; 90; 90; 120;  

COD ID: 2017504
CIF file

HKL data

Original IUCr paper

Formula: - C4 H12 Cu N10 O2 -
Comments: Lyakhov, Alexander S.; Voitekhovich, Sergei V.; Ivashkevich, Ludmila S.; Gaponik, Pavel N. A tetrazol-5-yl analogue of glycine, 5-ammoniomethyl-1<i>H</i>-tetrazolide, and its copper(II) complex Acta Crystallographica Section C 66(2) (2010) m22-m25
Space group: P 1 21/c 1
Cell volume: 541.3
Cell parameters: 7.0452; 8.907; 9.059; 90; 107.8; 90;  

COD ID: 2017505
CIF file

HKL data

Original IUCr paper

Formula: - C9 H12 I N O11 S U -
Comments: Sasikumar, Pandian; Muthiah, Packianathan Thomas Triaqua(μ-7-iodo-8-oxidoquinoline-5-sulfonato-κ^2^<i>N</i>,<i>O</i>^8^)dioxidouranium(VI) dihydrate Acta Crystallographica Section C 66(2) (2010) m48-m50
Space group: P -1
Cell volume: 878.04
Cell parameters: 8.3742; 10.1785; 11.6146; 74.958; 84.717; 66.701;  

COD ID: 2017506
CIF file

HKL data

Original IUCr paper

Formula: - C8 H Cs N4 O2 -
Comments: Tafeenko, Viktor A.; Gurskiy, Stanislav I.; Fazylbekov, Marat F.; Baranov, Andrey N.; Aslanov, Leonid A. Luminescence properties of the structure built from 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1<i>H</i>-pyrrol-2-olate and caesium(I) Acta Crystallographica Section C 66(2) (2010) m32-m34
Space group: P -1
Cell volume: 475.9
Cell parameters: 5.8737; 9.2927; 9.6759; 113.04; 90.834; 100.401;  

COD ID: 2017507
CIF file

Original IUCr paper

Formula: - C76 H56 Co2 N4 O18 -
Comments: Zhan, Ge; Li, Xin-Hua Poly[[<i>trans</i>-diaquabis(μ~2~-biphenyl-2,2'-dicarboxylato)bis(μ~2~-4,4'-bipyridine)dicobalt(II)] biphenyl-2,2'-dicarboxylic acid disolvate] Acta Crystallographica Section C 66(2) (2010) m29-m31
Space group: P 21 21 2
Cell volume: 3283.8
Cell parameters: 10.1264; 28.487; 11.3835; 90; 90; 90;  

COD ID: 2017508
CIF file

HKL data

Original IUCr paper

Formula: - C18 H28 Cl8 Cu3 N2 -
Comments: Bond, Marcus R. <i>catena</i>-Poly[bis(trimethylphenylammonium) [hexa-μ-chlorido-dichloridotricuprate(II)]]: an alternating zigzag chain of CuCl~4~ and Cu~2~Cl~6~ complexes Acta Crystallographica Section C 66(2) (2010) m17-m21
Space group: P 1 21/c 1
Cell volume: 1360.35
Cell parameters: 7.4496; 10.0211; 18.4713; 90; 99.42; 90;  

COD ID: 2017509
CIF file

HKL data

Original IUCr paper

Formula: - C28 H34 N4 O2 -
Comments: Kuś, Piotr; Borek, Jerzy; Jones, Peter G. Two concomitant polymorphs of <i>N</i>,<i>N</i>'-bis[4-(diethylamino)phenyl]terephthaldiamide Acta Crystallographica Section C 66(2) (2010) o93-o96
Space group: P -1
Cell volume: 584.2
Cell parameters: 5.11; 9.946; 12.107; 100.54; 93.9; 103.53;  

COD ID: 2017510
CIF file

HKL data

Original IUCr paper

Formula: - C28 H34 N4 O2 -
Comments: Kuś, Piotr; Borek, Jerzy; Jones, Peter G. Two concomitant polymorphs of <i>N</i>,<i>N</i>'-bis[4-(diethylamino)phenyl]terephthaldiamide Acta Crystallographica Section C 66(2) (2010) o93-o96
Space group: C 1 c 1
Cell volume: 2383.5
Cell parameters: 11.5899; 16.7899; 13.4785; 90; 114.667; 90;  

COD ID: 2017511
CIF file

HKL data

Original IUCr paper

Formula: - C13 H10 N2 O -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P b c a
Cell volume: 2079.25
Cell parameters: 14.6031; 6.2725; 22.6997; 90; 90; 90;  

COD ID: 2017512
CIF file

HKL data

Original IUCr paper

Formula: - C13 H9 N O S -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P b c n
Cell volume: 2157.32
Cell parameters: 11.9297; 10.8294; 16.6986; 90; 90; 90;  

COD ID: 2017513
CIF file

HKL data

Original IUCr paper

Formula: - C13 H11 N O3 -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P b c n
Cell volume: 2154.3
Cell parameters: 19.225; 5.0503; 22.1886; 90; 90; 90;  

COD ID: 2017514
CIF file

HKL data

Original IUCr paper

Formula: - C11 H11 N O -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P -1
Cell volume: 1311.46
Cell parameters: 9.7504; 10.2281; 14.053; 95.766; 107.842; 96.617;  

COD ID: 2017515
CIF file

HKL data

Original IUCr paper

Formula: - C13 H13 N O3 -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P 1 21/n 1
Cell volume: 2237.73
Cell parameters: 10.6939; 17.2595; 12.7714; 90; 108.322; 90;  

COD ID: 2017516
CIF file

HKL data

Original IUCr paper

Formula: - C14 H15 N O -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P -1
Cell volume: 1103.32
Cell parameters: 5.3732; 13.4962; 15.8088; 95.389; 98.498; 101.201;  

COD ID: 2017517
CIF file

HKL data

Original IUCr paper

Formula: - C11 H11 N O3 -
Comments: Spencer, John; Chowdhry, Babur Z.; Hamid, Samiyah; Mendham, Andrew P.; Male, Louise; Coles, Simon J.; Hursthouse, Michael B. Seven 3-methylidene-1<i>H</i>-indol-2(3<i>H</i>)-ones related to the multiple-receptor tyrosine kinase inhibitor sunitinib Acta Crystallographica Section C 66(2) (2010) o71-o78
Space group: P 1 21/c 1
Cell volume: 976.42
Cell parameters: 9.5406; 8.4295; 12.4103; 90; 101.956; 90;  

COD ID: 2017518
CIF file

HKL data

Original IUCr paper

Formula: - C13.375 H25.5 O11.375 -
Comments: Hu, Xiaosong; Pan, Qingfeng; Noll, Bruce C.; Oliver, Allen G.; Serianni, Anthony S. Methyl 4-<i>O</i>-β-<small>D</small>-galactopyranosyl α-<small>D</small>-mannopyranoside methanol 0.375-solvate Acta Crystallographica Section C 66(2) (2010) o67-o70
Space group: I 4
Cell volume: 3449.37
Cell parameters: 20.1789; 20.1789; 8.4712; 90; 90; 90;  

COD ID: 2017519
CIF file

HKL data

Original IUCr paper

Formula: - C22 H16 N4 O2 Pb2 S2 -
Comments: Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Langer, Vratislav Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline and thiocyanate Acta Crystallographica Section C 66(2) (2010) m44-m47
Space group: P -1
Cell volume: 555.5
Cell parameters: 7.8556; 8.4155; 9.155; 78.524; 69.771; 82.813;  

COD ID: 2017520
CIF file

HKL data

Original IUCr paper

Formula: - C22 H16 N4 O2 Pb2 S2 -
Comments: Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Langer, Vratislav Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline and thiocyanate Acta Crystallographica Section C 66(2) (2010) m44-m47
Space group: P 1 21/c 1
Cell volume: 1126.3
Cell parameters: 12.037; 5.731; 16.327; 90; 90.368; 90;  

COD ID: 2017521
CIF file

HKL data

Original IUCr paper

Formula: - C18 H36 Cl2 N2 O6 S -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Clindamycin hydrochloride monohydrate and its ethanol solvate Acta Crystallographica Section C 66(2) (2010) o97-o100
Space group: P 1 21 1
Cell volume: 1227.08
Cell parameters: 9.4669; 9.9255; 13.4949; 90; 104.601; 90;  

COD ID: 2017522
CIF file

HKL data

Original IUCr paper

Formula: - C20 H42 Cl2 N2 O7 S -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Clindamycin hydrochloride monohydrate and its ethanol solvate Acta Crystallographica Section C 66(2) (2010) o97-o100
Space group: P 21 21 21
Cell volume: 2806.2
Cell parameters: 9.963; 10.6998; 26.324; 90; 90; 90;  

COD ID: 2017523
CIF file

HKL data

Original IUCr paper

Formula: - C23 H27 N3 O2 -
Comments: Castillo, Juan C.; Abonía, Rodrigo; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher <i>N</i>-(3-<i>tert</i>-Butyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)-<i>N</i>-(4-methoxybenzyl)acetamide: a hydrogen-bonded chain of centrosymmetric rings Acta Crystallographica Section C 66(2) (2010) o64-o66
Space group: P -1
Cell volume: 1037.44
Cell parameters: 9.8325; 9.8649; 12.0365; 97.468; 95.512; 114.643;  

COD ID: 2017524
CIF file

HKL data

Original IUCr paper

Formula: - Cs2 O21 P4 V3 -
Comments: Gautier, Romain; Colin, Jean-François; Le Fur, Eric Two caesium vanadium hydrogenphosphates with tunnelled structures: Cs~2~V~2~O~3~(PO~4~)(HPO~4~) and Cs~2~[(VO)~3~(HPO~4~)~4~(H~2~O)]·H~2~O Acta Crystallographica Section C 66(2) (2010) i12-i15
Space group: P 1 21/c 1
Cell volume: 1878.77
Cell parameters: 12.5465; 11.9181; 12.6531; 90; 96.7859; 90;  

COD ID: 2017525
CIF file

HKL data

Original IUCr paper

Formula: - Cs2 O11 P2 V2 -
Comments: Gautier, Romain; Colin, Jean-François; Le Fur, Eric Two caesium vanadium hydrogenphosphates with tunnelled structures: Cs~2~V~2~O~3~(PO~4~)(HPO~4~) and Cs~2~[(VO)~3~(HPO~4~)~4~(H~2~O)]·H~2~O Acta Crystallographica Section C 66(2) (2010) i12-i15
Space group: P 1 21/c 1
Cell volume: 1077.52
Cell parameters: 8.918; 16.9479; 7.2199; 90; 99.092; 90;  

COD ID: 2017526
CIF file

HKL data

Original IUCr paper

Formula: - H3 Nd O9 S2 -
Comments: Zhang, Zaichao; Zhang, Zhibin (H~3~O)Nd(SO~4~)~2~ Acta Crystallographica Section C 66(2) (2010) i9-i11
Space group: P 1 21/c 1
Cell volume: 686.28
Cell parameters: 8.8593; 7.1787; 10.7955; 90; 91.671; 90;  

COD ID: 2017527
CIF file

Original IUCr paper

Formula: - F8 K3 Ta -
Comments: Smrčok, Ľubomír; Černý, Radovan; Boča, Miroslav; Macková, Iveta; Kubíková, Blanka K~3~TaF~8~ from laboratory X-ray powder data Acta Crystallographica Section C 66(2) (2010) i16-i18
Space group: P 63 m c
Cell volume: 372.8
Cell parameters: 8.2533; 8.2533; 6.3196; 90; 90; 120;  

COD ID: 2017528
CIF file

HKL data

Original IUCr paper

Formula: - C7 H15 Au Cl4 N2 O4 S -
Comments: Rychlewska, Urszula; Warzajtis, Beata; Glisic, Biljana D.; Rajkovic, Snezana; Djuran, Miloš Crystallographic evidence of Gly-<small>D</small>,<small>L</small>-Met oxidation to its sulfoxide in the presence of gold(III): solid solution of the racemic mixture of two diastereoisomers Acta Crystallographica Section C 66(2) (2010) m51-m54
Space group: P -1
Cell volume: 795.46
Cell parameters: 7.625; 10.2576; 10.716; 95.281; 107.222; 92.001;  

COD ID: 2017529
CIF file

HKL data

Original IUCr paper

Formula: - C16 H13 N O3 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P 1 21/c 1
Cell volume: 1241.6
Cell parameters: 13.876; 5.7725; 16.28; 90; 107.799; 90;  

COD ID: 2017530
CIF file

HKL data

Original IUCr paper

Formula: - C17 H15 N O3 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 674.4
Cell parameters: 6.873; 7.67; 13.394; 99.48; 101.68; 96.33;  

COD ID: 2017531
CIF file

HKL data

Original IUCr paper

Formula: - C16 H12 F N O3 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 641.43
Cell parameters: 6.8858; 7.7074; 12.701; 98.229; 103.667; 96.034;  

COD ID: 2017532
CIF file

HKL data

Original IUCr paper

Formula: - C16 H12 Cl N O3 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 662.4
Cell parameters: 6.987; 7.689; 12.907; 99.3; 101.82; 96.33;  

COD ID: 2017533
CIF file

HKL data

Original IUCr paper

Formula: - C16 H12 Br N O3 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 675.8
Cell parameters: 7.016; 7.7349; 13.052; 99.69; 101.51; 96.7;  

COD ID: 2017534
CIF file

HKL data

Original IUCr paper

Formula: - C16 H12 N2 O5 -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 682.7
Cell parameters: 7.026; 7.598; 13.365; 97.54; 102.67; 96.46;  

COD ID: 2017535
CIF file

HKL data

Original IUCr paper

Formula: - C14 H11 N O3 S -
Comments: Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones Acta Crystallographica Section C 66(2) (2010) o79-o86
Space group: P -1
Cell volume: 601.8
Cell parameters: 6.5958; 7.9577; 12.045; 78.51; 76.555; 84.559;  

COD ID: 2017536
CIF file

HKL data

Original IUCr paper

Formula: - C59 H73 Cl6 Co N3 O14 P2 -
Comments: Becker, Clifford A. L.; Black, Robert S.; Forbes, Roy P. Tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(I) perchlorate dichloromethane disolvate and tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(II) bis(perchlorate) dichloromethane disolvate: modification of a trigonal‒bipyramidal structure with change of metal oxidation state Acta Crystallographica Section C 66(2) (2010) m40-m43
Space group: P 1 21/n 1
Cell volume: 6929.9
Cell parameters: 12.3461; 19.7566; 28.4452; 90; 92.818; 90;  

COD ID: 2017537
CIF file

HKL data

Original IUCr paper

Formula: - C59 H73 Cl5 Co N3 O10 P2 -
Comments: Becker, Clifford A. L.; Black, Robert S.; Forbes, Roy P. Tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(I) perchlorate dichloromethane disolvate and tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(II) bis(perchlorate) dichloromethane disolvate: modification of a trigonal‒bipyramidal structure with change of metal oxidation state Acta Crystallographica Section C 66(2) (2010) m40-m43
Space group: P 63/m
Cell volume: 9591.9
Cell parameters: 21.7568; 21.7568; 23.3983; 90; 90; 120;  

COD ID: 2017538
CIF file

HKL data

Original IUCr paper

Formula: - C38 H34 O10 -
Comments: Mehta, Goverdhan; Sen, Saikat Modulating the preferred O—H···O hydrogen-bonding motif in a conformationally constrained environment through hydroxy-group derivatization Acta Crystallographica Section C 66(2) (2010) o59-o63
Space group: P 1 21/c 1
Cell volume: 1607.6
Cell parameters: 9.734; 15.993; 10.827; 90; 107.488; 90;  

COD ID: 2017539
CIF file

HKL data

Original IUCr paper

Formula: - C14 H22 O6 -
Comments: Mehta, Goverdhan; Sen, Saikat Modulating the preferred O—H···O hydrogen-bonding motif in a conformationally constrained environment through hydroxy-group derivatization Acta Crystallographica Section C 66(2) (2010) o59-o63
Space group: P 1 21/n 1
Cell volume: 1423.3
Cell parameters: 9.888; 14.747; 10.417; 90; 110.444; 90;  

COD ID: 2017540
CIF file

HKL data

Original IUCr paper

Formula: - C24 H26 O6 -
Comments: Mehta, Goverdhan; Sen, Saikat Modulating the preferred O—H···O hydrogen-bonding motif in a conformationally constrained environment through hydroxy-group derivatization Acta Crystallographica Section C 66(2) (2010) o59-o63
Space group: P 1 21/c 1
Cell volume: 2144.4
Cell parameters: 16.246; 11.167; 11.829; 90; 92.219; 90;  

COD ID: 2017541
CIF file

HKL data

Original IUCr paper

Formula: - C10 H8 Cl2 N2 O5 -
Comments: Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki Two solid phases of pyrimidin-1-ium hydrogen chloranilate monohydrate determined at 225 and 120K Acta Crystallographica Section C 66(3) (2010) o114-o118
Space group: P 1 21/c 1
Cell volume: 1161.12
Cell parameters: 12.6621; 3.75947; 26.7435; 90; 114.208; 90;  

COD ID: 2017542
CIF file

HKL data

Original IUCr paper

Formula: - C10 H8 Cl2 N2 O5 -
Comments: Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki Two solid phases of pyrimidin-1-ium hydrogen chloranilate monohydrate determined at 225 and 120K Acta Crystallographica Section C 66(3) (2010) o114-o118
Space group: P 1 21/n 1
Cell volume: 2282.16
Cell parameters: 25.5952; 3.71581; 26.3761; 90; 114.529; 90;  

COD ID: 2017543
CIF file

HKL data

Original IUCr paper

Formula: - C17 H16 N O0.42 P -
Comments: Broomfield, Lewis M.; Bochmann, Manfred; Wright, Joseph A. 2-(Diphenylphosphinoylmethyl)pyrrole‒2-(diphenylphosphinomethyl)pyrrole (0.43/0.57) and tetrachlorido(5-diphenylphosphinomethyl-2<i>H</i>-pyrrole-κ^2^<i>N</i>,<i>P</i>)titanium(IV) Acta Crystallographica Section C 66(3) (2010) m79-m82
Space group: P 1 21/c 1
Cell volume: 2941.9
Cell parameters: 9.6282; 15.2848; 20.391; 90; 101.376; 90;  

COD ID: 2017544
CIF file

HKL data

Original IUCr paper

Formula: - C17 H16 Cl4 N P Ti -
Comments: Broomfield, Lewis M.; Bochmann, Manfred; Wright, Joseph A. 2-(Diphenylphosphinoylmethyl)pyrrole‒2-(diphenylphosphinomethyl)pyrrole (0.43/0.57) and tetrachlorido(5-diphenylphosphinomethyl-2<i>H</i>-pyrrole-κ^2^<i>N</i>,<i>P</i>)titanium(IV) Acta Crystallographica Section C 66(3) (2010) m79-m82
Space group: P -1
Cell volume: 955.6
Cell parameters: 8.1481; 8.6323; 14.202; 98.159; 98.727; 100.588;  

COD ID: 2017545
CIF file

HKL data

Original IUCr paper

Formula: - C O3 Tl2 -
Comments: Grzechnik, A.; Friese, K. Crystal structure and stability of Tl~2~CO~3~ at high pressures Acta Crystallographica Section C 66(3) (2010) i37-i38
Space group: C 1 2/m 1
Cell volume: 377.5
Cell parameters: 12.02; 5.15; 7.198; 90; 122.08; 90;  

COD ID: 2017546
CIF file

HKL data

Original IUCr paper

Formula: - C10 H11 N O2 S -
Comments: Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates Acta Crystallographica Section C 66(3) (2010) o141-o146
Space group: P n a 21
Cell volume: 1017.64
Cell parameters: 9.9418; 9.3619; 10.9337; 90; 90; 90;  

COD ID: 2017547
CIF file

HKL data

Original IUCr paper

Formula: - C11 H13 N O2 S -
Comments: Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates Acta Crystallographica Section C 66(3) (2010) o141-o146
Space group: P 1 21/c 1
Cell volume: 1099.6
Cell parameters: 12.2845; 9.1431; 9.7897; 90; 90.182; 90;  

COD ID: 2017548
CIF file

HKL data

Original IUCr paper

Formula: - C13 H17 N O2 S -
Comments: Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates Acta Crystallographica Section C 66(3) (2010) o141-o146
Space group: P -1
Cell volume: 629.19
Cell parameters: 7.247; 8.887; 10.737; 100.691; 99.984; 107.307;  

COD ID: 2017549
CIF file

HKL data

Original IUCr paper

Formula: - C12 H14 Cl N O2 S -
Comments: Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates Acta Crystallographica Section C 66(3) (2010) o141-o146
Space group: P -1
Cell volume: 633.7
Cell parameters: 7.8028; 9.48; 9.86; 69.545; 75.683; 69.548;  

COD ID: 2017550
CIF file

HKL data

Original IUCr paper

Formula: - C60 H96 N4 O10 Sn4 -
Comments: Linden, Anthony; Basu Baul, Tushar S.; Das, Pradip Tetrakis(μ~2~-4-aminobenzoato)di-μ~3~-oxido-tetrakis[dibutyltin(IV)] Acta Crystallographica Section C 66(3) (2010) m58-m61
Space group: P 1 21/c 1
Cell volume: 3255.75
Cell parameters: 12.3017; 17.1436; 15.8633; 90; 103.301; 90;  

COD ID: 2017551
CIF file

HKL data

Original IUCr paper

Formula: - C6 H12 N2 O2 -
Comments: Czapik, Agnieszka; Konowalska, Hanna; Gdaniec, Maria <i>p</i>-Phenylenediamine and its dihydrate: two-dimensional isomorphism and mechanism of the dehydration process, and N—H···N and N—H···π interactions Acta Crystallographica Section C 66(3) (2010) o128-o132
Space group: P n m a
Cell volume: 784.76
Cell parameters: 8.8599; 15.0248; 5.8952; 90; 90; 90;  

COD ID: 2017552
CIF file

HKL data

Original IUCr paper

Formula: - C6 H8 N2 -
Comments: Czapik, Agnieszka; Konowalska, Hanna; Gdaniec, Maria <i>p</i>-Phenylenediamine and its dihydrate: two-dimensional isomorphism and mechanism of the dehydration process, and N—H···N and N—H···π interactions Acta Crystallographica Section C 66(3) (2010) o128-o132
Space group: P 1 21/c 1
Cell volume: 1112.09
Cell parameters: 8.302; 5.897; 22.76; 90; 93.579; 90;  

COD ID: 2017553
CIF file

HKL data

Original IUCr paper

Formula: - C16 H44 Cu Na2 O16 -
Comments: Rivers, Joseph H.; Carroll, Kyler J.; Jones, Richard A.; Carpenter, Everett E. A copper‒polyol complex: [Na~2~(C~2~H~6~O~2~)~6~][Cu(C~2~H~4~O~2~)~2~] Acta Crystallographica Section C 66(3) (2010) m83-m85
Space group: P -1
Cell volume: 701.61
Cell parameters: 8.7666; 9.5089; 9.7804; 99.152; 101.983; 113.91;  

COD ID: 2017554
CIF file

HKL data

Original IUCr paper

Formula: - Al0.19 Fe0.81 H6 O12 P3 -
Comments: Belfguira, Nadia; Walha, Siwar; Ben Salah, Abdelhamid; Fransolet, André Mathieu; Kabadou, Ahlem The solid solution (Fe~0.81~Al~0.19~)(H~2~PO~4~)~3~ with a strong hydrogen bond Acta Crystallographica Section C 66(3) (2010) i33-i36
Space group: C 1 c 1
Cell volume: 908.6
Cell parameters: 11.7; 15.59; 5.03; 90; 98; 90;  

COD ID: 2017555
CIF file

HKL data

Original IUCr paper

Formula: - La2 Pb S8 Si2 -
Comments: Gulay, L. D.; Daszkiewicz, M.; Ruda, I. P.; Marchuk, O. V. La~2~Pb(SiS~4~)~2~ Acta Crystallographica Section C 66(3) (2010) i19-i21
Space group: R -3 c :H
Cell volume: 1913.5
Cell parameters: 9.0522; 9.0522; 26.964; 90; 90; 120;  

COD ID: 2017556
CIF file

HKL data

Original IUCr paper

Formula: - C20 H21 Cl N4 O2 -
Comments: Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate Acta Crystallographica Section C 66(3) (2010) o104-o108
Space group: C 1 2/c 1
Cell volume: 4099.77
Cell parameters: 17.1373; 16.4776; 16.6127; 90; 119.08; 90;  

COD ID: 2017557
CIF file

HKL data

Original IUCr paper

Formula: - C18 H18 Cl N5 O3 -
Comments: Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate Acta Crystallographica Section C 66(3) (2010) o104-o108
Space group: P 1 21/c 1
Cell volume: 1856.89
Cell parameters: 11.2563; 14.3968; 11.7902; 90; 103.625; 90;  

COD ID: 2017558
CIF file

HKL data

Original IUCr paper

Formula: - C19 H17 Cl3 N4 O2 -
Comments: Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate Acta Crystallographica Section C 66(3) (2010) o104-o108
Space group: P b c a
Cell volume: 4084.96
Cell parameters: 14.3808; 12.6799; 22.4021; 90; 90; 90;  

COD ID: 2017559
CIF file

HKL data

Original IUCr paper

Formula: - C6 H9 Cl N O4 P -
Comments: Balamurugan, P.; Jagan, R.; Sivakumar, K. Dihydrogen phosphate mediated supramolecular frameworks in 2- and 4-chloroanilinium dihydrogen phosphate salts Acta Crystallographica Section C 66(3) (2010) o109-o113
Space group: P 1 21/n 1
Cell volume: 891.17
Cell parameters: 11.3143; 4.7466; 17.5024; 90; 108.54; 90;  

COD ID: 2017560
CIF file

HKL data

Original IUCr paper

Formula: - C6 H9 Cl N O4 P -
Comments: Balamurugan, P.; Jagan, R.; Sivakumar, K. Dihydrogen phosphate mediated supramolecular frameworks in 2- and 4-chloroanilinium dihydrogen phosphate salts Acta Crystallographica Section C 66(3) (2010) o109-o113
Space group: P b c a
Cell volume: 1928
Cell parameters: 9.7371; 7.8756; 25.141; 90; 90; 90;  

COD ID: 2017561
CIF file

HKL data

Original IUCr paper

Formula: - C16 H13 Cl2 P Zr -
Comments: Büschel, Susanne; Daniliuc, Constantin; Jones, Peter G.; Tamm, Matthias The <i>ansa</i>-zirconocene [bis(η^5^-cyclopentadienyl)phenylphosphine]dichloridozirconium(IV) Acta Crystallographica Section C 66(3) (2010) m86-m88
Space group: C 1 2/c 1
Cell volume: 3038.44
Cell parameters: 27.2712; 7.3272; 15.4592; 90; 100.389; 90;  

COD ID: 2017562
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 N2 O12 U -
Comments: Lennartson, Anders; Håkansson, Mikael Hydrogen-bonded network structures in dipyridinium, bis(2-methylpyridinium), bis(3-methylpyridinium) and bis(4-methylpyridinium) dioxidobis(oxydiacetato)uranate(VI) Acta Crystallographica Section C 66(3) (2010) m69-m74
Space group: P 1 21/m 1
Cell volume: 1076.5
Cell parameters: 6.675; 23.025; 7.5; 90; 110.946; 90;  

COD ID: 2017563
CIF file

HKL data

Original IUCr paper

Formula: - C20 H24 N2 O12 U -
Comments: Lennartson, Anders; Håkansson, Mikael Hydrogen-bonded network structures in dipyridinium, bis(2-methylpyridinium), bis(3-methylpyridinium) and bis(4-methylpyridinium) dioxidobis(oxydiacetato)uranate(VI) Acta Crystallographica Section C 66(3) (2010) m69-m74
Space group: P 1 21/c 1
Cell volume: 1216.9
Cell parameters: 9.183; 11.104; 12.826; 90; 111.49; 90;  

COD ID: 2017564
CIF file

HKL data

Original IUCr paper

Formula: - C20 H24 N2 O12 U -
Comments: Lennartson, Anders; Håkansson, Mikael Hydrogen-bonded network structures in dipyridinium, bis(2-methylpyridinium), bis(3-methylpyridinium) and bis(4-methylpyridinium) dioxidobis(oxydiacetato)uranate(VI) Acta Crystallographica Section C 66(3) (2010) m69-m74
Space group: P 1 21/c 1
Cell volume: 1165.1
Cell parameters: 7.415; 13.312; 11.806; 90; 91.224; 90;  

COD ID: 2017565
CIF file

HKL data

Original IUCr paper

Formula: - C20 H24 N2 O12 U -
Comments: Lennartson, Anders; Håkansson, Mikael Hydrogen-bonded network structures in dipyridinium, bis(2-methylpyridinium), bis(3-methylpyridinium) and bis(4-methylpyridinium) dioxidobis(oxydiacetato)uranate(VI) Acta Crystallographica Section C 66(3) (2010) m69-m74
Space group: P 1 21/c 1
Cell volume: 1163
Cell parameters: 7.3439; 12.999; 12.194; 90; 92.438; 90;  

COD ID: 2017566
CIF file

HKL data

Original IUCr paper

Formula: - C24 H23 Cl3 Ir N3 O S -
Comments: Hinkle, Lindsay M.; Young, Jr, Victor G.; Mann, Kent R. Mono- and bis-tolylterpyridine iridium(III) complexes Acta Crystallographica Section C 66(3) (2010) m62-m64
Space group: P 1 21/c 1
Cell volume: 2488.9
Cell parameters: 10.377; 23.166; 10.37; 90; 93.22; 90;  

COD ID: 2017567
CIF file

HKL data

Original IUCr paper

Formula: - C48 H40 F18 Ir N8 P3 -
Comments: Hinkle, Lindsay M.; Young, Jr, Victor G.; Mann, Kent R. Mono- and bis-tolylterpyridine iridium(III) complexes Acta Crystallographica Section C 66(3) (2010) m62-m64
Space group: C 1 2/c 1
Cell volume: 4964
Cell parameters: 14.6977; 16.3737; 21.42; 90; 105.639; 90;  

COD ID: 2017568
CIF file

HKL data

Original IUCr paper

Formula: - C14 H19 F O9 -
Comments: Dedola, Simone; Hughes, David L.; Field, Robert A. Peracetylated α-<small>D</small>-glucopyranosyl fluoride and peracetylated α-maltosyl fluoride Acta Crystallographica Section C 66(3) (2010) o124-o127
Space group: P 1 21 1
Cell volume: 857.07
Cell parameters: 5.35502; 7.96182; 20.1151; 90; 92.061; 90;  

COD ID: 2017569
CIF file

HKL data

Original IUCr paper

Formula: - C26 H35 F O17 -
Comments: Dedola, Simone; Hughes, David L.; Field, Robert A. Peracetylated α-<small>D</small>-glucopyranosyl fluoride and peracetylated α-maltosyl fluoride Acta Crystallographica Section C 66(3) (2010) o124-o127
Space group: P 1 21 1
Cell volume: 1523.1
Cell parameters: 5.63832; 18.2908; 14.8144; 90; 94.4966; 90;  

COD ID: 2017570
CIF file

HKL data

Original IUCr paper

Formula: - C16 H22 N4 O4 -
Comments: Tvedte, Laura M.; Smith, Kenneth L.; Patterson, Eric V.; Baughman, Russell G. 2-Amino-5-(3,4-dimethoxybenzylidene)-1-methylimidazol-4(5<i>H</i>)-one <i>N</i>,<i>N</i>-dimethylformamide monosolvate Acta Crystallographica Section C 66(3) (2010) o101-o103
Space group: P 1 21/c 1
Cell volume: 1689
Cell parameters: 11.617; 17.2235; 9.062; 90; 111.327; 90;  

COD ID: 2017571
CIF file

HKL data

Original IUCr paper

Formula: - Ba2 Gd2 O13 Si4 -
Comments: Wierzbicka-Wieczorek, Maria; Kolitsch, Uwe; Tillmanns, Ekkehart Ba~2~Gd~2~(Si~4~O~13~): a silicate with finite Si~4~O~13~ chains Acta Crystallographica Section C 66(3) (2010) i29-i32
Space group: C 1 2/c 1
Cell volume: 1144.1
Cell parameters: 12.896; 5.212; 17.549; 90; 104.08; 90;  

COD ID: 2017572
CIF file

HKL data

Original IUCr paper

Formula: - B2 F8 Sr -
Comments: Goreshnik, Evgeny; Vakulka, Andrii; Žemva, Boris Strontium tetrafluoroborate. Erratum Acta Crystallographica Section C 66(3) (2010) e9
Space group: P b c a
Cell volume: 1234.9
Cell parameters: 9.602; 9.259; 13.89; 90; 90; 90;  

COD ID: 2017573
CIF file

HKL data

Original IUCr paper

Formula: - C10 H11 Ag N4 O3 -
Comments: Sun, Di; Zhang, Na; Luo, Geng-Geng; Huang, Rong-Bin; Zheng, Lan-Sun Ammine(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')silver(I) nitrate: a dimer formed by π‒π stacking and ligand-unsupported Ag···Ag interactions Acta Crystallographica Section C 66(3) (2010) m75-m78
Space group: C 1 2/c 1
Cell volume: 2403
Cell parameters: 17.685; 10.69; 12.748; 90; 94.457; 90;  

COD ID: 2017574
CIF file

HKL data

Original IUCr paper

Formula: - C30 H37 N5 O9 -
Comments: Makowski, Maciej; Lisowski, Marek; Maciag, Anna; Wiktor, Maciej; Szlachcic, Anna; Lis, Tadeusz Two pentadehydropeptides with different configurations of the ΔPhe residues Acta Crystallographica Section C 66(3) (2010) o119-o123
Space group: P 1 21/c 1
Cell volume: 3030.2
Cell parameters: 14.075; 16.577; 14.041; 90; 112.34; 90;  

COD ID: 2017575
CIF file

HKL data

Original IUCr paper

Formula: - C29 H33 N5 O8 -
Comments: Makowski, Maciej; Lisowski, Marek; Maciag, Anna; Wiktor, Maciej; Szlachcic, Anna; Lis, Tadeusz Two pentadehydropeptides with different configurations of the ΔPhe residues Acta Crystallographica Section C 66(3) (2010) o119-o123
Space group: P 1 21/c 1
Cell volume: 3010
Cell parameters: 13.52; 22.922; 9.795; 90; 97.41; 90;  

COD ID: 2017576
CIF file

HKL data

Original IUCr paper

Formula: - C12 H24 N4 Na O11.5 -
Comments: Gainsford, Graeme J.; Furneaux, Richard H.; Tyler, Peter C.; Sauve, Anthony; Shramm, Vern L. A synchrotron radiation study of the one-dimensional complex of sodium with (1<i>S</i>)-<i>N</i>-carboxylato-1-(9-deazaadenin-9-yl)-1,4-dideoxy-1,4-imino-<small>D</small>-ribitol, a member of the 'immucillin' family Acta Crystallographica Section C 66(3) (2010) m65-m68
Space group: P 1
Cell volume: 912.1
Cell parameters: 7.662; 10.488; 11.606; 98.24; 91.07; 98.49;  

COD ID: 2017577
CIF file

HKL data

Original IUCr paper

Formula: - C19 H16 N6 -
Comments: Portilla, Jaime; Estupiñan, Diego; Cobo, Justo; Glidewell, Christopher 7-Amino-5-methyl-2-phenyl-6-(phenyldiazenyl)pyrazolo[1,5-<i>a</i>]pyrimidine crystallizes with <i>Z</i>' = 2: pseudosymmetry and the formation of complex sheets built from N—H···N and C—H···π(arene) hydrogen bonds Acta Crystallographica Section C 66(3) (2010) o133-o136
Space group: P 1 21/n 1
Cell volume: 3119.1
Cell parameters: 9.6342; 33.216; 9.747; 90; 90.237; 90;  

COD ID: 2017578
CIF file

HKL data

Original IUCr paper

Formula: - C26 H19 Cl2 N5 -
Comments: Díaz, Yurina; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher (<i>E</i>)-<i>N</i>-{[6-Chloro-4-(4-chlorophenyl)-3-methyl-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridin-5-yl]methylene}benzene-1,2-diamine: a three-dimensional framework structure built from only two hydrogen bonds Acta Crystallographica Section C 66(3) (2010) o137-o140
Space group: P n a 21
Cell volume: 2184.4
Cell parameters: 10.013; 12.3487; 17.666; 90; 90; 90;  

COD ID: 2017579
CIF file

HKL data

Original IUCr paper

Formula: - La6 Mg2.77 Zn19.23 -
Comments: Pavlyuk, Volodymyr; Rozycka-Sokolowska, Ewa; Marciniak, Bernard The new ternary phases of La~3~(Zn~0.874~Mg~0.126~)~11~ and Ce~3~(Zn~0.863~Mg~0.137~)~11~ Acta Crystallographica Section C 66(3) (2010) i25-i28
Space group: I m m m
Cell volume: 577.13
Cell parameters: 4.5992; 9.0514; 13.8635; 90; 90; 90;  

COD ID: 2017580
CIF file

HKL data

Original IUCr paper

Formula: - Ce6 Mg3.02 Zn18.98 -
Comments: Pavlyuk, Volodymyr; Rozycka-Sokolowska, Ewa; Marciniak, Bernard The new ternary phases of La~3~(Zn~0.874~Mg~0.126~)~11~ and Ce~3~(Zn~0.863~Mg~0.137~)~11~ Acta Crystallographica Section C 66(3) (2010) i25-i28
Space group: I m m m
Cell volume: 560.96
Cell parameters: 4.5641; 8.9542; 13.7261; 90; 90; 90;  

COD ID: 2017581
CIF file

HKL data

Original IUCr paper

Formula: - Ba5 Cl4 H16 O48 P8 V8 -
Comments: Zhang, Ai-Yun; Zheng, Juan; Wang, Qiu-Fen Ba~5~Cl~4~(H~2~O)~8~(VPO~5~)~8~: a novel three-dimensional framework solid Acta Crystallographica Section C 66(3) (2010) i22-i24
Space group: C m c a
Cell volume: 4256
Cell parameters: 13.5073; 8.8803; 35.482; 90; 90; 90;  

COD ID: 2017582
CIF file

HKL data

Original IUCr paper

Formula: - C18 H21 Au Cl P -
Comments: Guzei, Ilia A.; Arachchige, Indika; Ivanov, Sergei A. Two polymorphs of chlorido(cyclohexyldiphenylphosphine)gold(I) Acta Crystallographica Section C 66(3) (2010) m55-m57
Space group: P 1 21/n 1
Cell volume: 1721.97
Cell parameters: 9.0059; 17.2762; 11.0719; 90; 91.61; 90;  

COD ID: 2017583
CIF file

HKL data

Original IUCr paper

Formula: - C18 H21 Au Cl P -
Comments: Guzei, Ilia A.; Arachchige, Indika; Ivanov, Sergei A. Two polymorphs of chlorido(cyclohexyldiphenylphosphine)gold(I) Acta Crystallographica Section C 66(3) (2010) m55-m57
Space group: P 1 21/c 1
Cell volume: 1717.8
Cell parameters: 13.144; 11.49; 13.1056; 90; 119.786; 90;  

COD ID: 2017584
CIF file

HKL data

Original IUCr paper

Formula: - C8 H15 N5 O8 -
Comments: Martinez Belmonte, Marta; Price, Daniel J. Strong asymmetric hydrogen bonding in 2-(oxamoylamino)ethylammonium oxamate‒oxamic acid (1/1) Acta Crystallographica Section C 66(3) (2010) o147-o150
Space group: P -1
Cell volume: 623.43
Cell parameters: 5.1723; 10.356; 12.1866; 97.765; 97.304; 102.394;  

COD ID: 2017585
CIF file

HKL data

Original IUCr paper

Formula: - C12 H13 N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P 1 21/n 1
Cell volume: 960.8
Cell parameters: 9.807; 7.3982; 13.738; 90; 105.441; 90;  

COD ID: 2017586
CIF file

HKL data

Original IUCr paper

Formula: - C15 H18 Cl N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P 1 21/n 1
Cell volume: 1309.8
Cell parameters: 11.0631; 5.7212; 21.203; 90; 102.587; 90;  

COD ID: 2017587
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 Cl N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P 1 21/n 1
Cell volume: 1200.6
Cell parameters: 8.6828; 10.1456; 14.2976; 90; 107.587; 90;  

COD ID: 2017588
CIF file

HKL data

Original IUCr paper

Formula: - C13 H13 Cl2 N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P 1 21 1
Cell volume: 605.13
Cell parameters: 10.4753; 5.4759; 10.9632; 90; 105.791; 90;  

COD ID: 2017589
CIF file

HKL data

Original IUCr paper

Formula: - C11 H6 F4 N2 O4 -
Comments: Yu, Li-Li; Cheng, Mei-Ling; Liu, Qi; Zhang, Zhi-Hui; Chen, Qun Three-dimensional supramolecular architecture in imidazolium hydrogen 2,3,5,6-tetrafluoroterephthalate Acta Crystallographica Section C 66(4) (2010) o179-o181
Space group: P n a 21
Cell volume: 1222.5
Cell parameters: 9.716; 7.229; 17.406; 90; 90; 90;  

COD ID: 2017590
CIF file

HKL data

Original IUCr paper

Formula: - C9 H11 Cd2 N O13 -
Comments: Yan, Sitang; Shi, Lianxu; Wu, Chuande Poly[[tetraaqua(μ~7~-pyridine-2,3,5,6-tetracarboxylato)dicadmium(II)] monohydrate] Acta Crystallographica Section C 66(4) (2010) m110-m113
Space group: P -1
Cell volume: 701.48
Cell parameters: 8.3989; 8.535; 11.4883; 89.325; 69.014; 67.269;  

COD ID: 2017591
CIF file

HKL data

Original IUCr paper

Formula: - C48 H52 Cd2 N4 O24 -
Comments: Wang, Suna; Li, Dacheng; Dou, Jianmin; Wang, Daqi An unusual polycatenating network self-assembled by the 2D →2D parallel →3D parallel interpenetration of coordinative and hydrogen-bonded (6,3) motifs Acta Crystallographica Section C 66(4) (2010) m118-m121
Space group: P -1
Cell volume: 1241.35
Cell parameters: 10.8627; 11.1883; 11.3773; 69.362; 79.777; 74.451;  

COD ID: 2017592
CIF file

HKL data

Original IUCr paper

Formula: - C20 H49 N8 Na3 O34 P8 -
Comments: Freire, Eleonora; Vega, Daniel R.; Baggio, Ricardo Zoledronate complexes. II. <i>catena</i>-Poly[[tetraaquabis[hemihydrogen μ~3~-1-hydroxy-2-(imidazol-3-ium-1-yl)ethylidene-1,1-diphosphonato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>'']bis[μ~3~-1-hydroxy-2-(imidazol-3-ium-1-yl)ethylidene-1,1-diphosphonato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'']trisodium] dihydrate] Acta Crystallographica Section C 66(4) (2010) m122-m126
Space group: P -1
Cell volume: 1110
Cell parameters: 9.069; 11.309; 12.594; 115.58; 98.86; 99.76;  

COD ID: 2017593
CIF file

Original IUCr paper

Formula: - C26 H28 B2 N4 O6 -
Comments: Vega, Araceli; Zarate, Maria; Tlahuext, Hugo; Höpfl, Herbert Benzene-1,4-diboronic acid‒4,4'-bipyridine‒water (1/2/2) Acta Crystallographica Section C 66(4) (2010) o219-o221
Space group: P -1
Cell volume: 1281.3
Cell parameters: 6.8262; 10.1914; 18.834; 98.825; 90.804; 98;  

COD ID: 2017594
CIF file

HKL data

Original IUCr paper

Formula: - C19 H16 Br N3 -
Comments: Quiroga, Jairo; Trilleras, Jorge; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher A hydrogen-bonded dimer in 6-(4-bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine and a chain of rings built from N—H···N and C—H···π(pyridine) hydrogen bonds in 3-(4-nitrophenyl)-4-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine Acta Crystallographica Section C 66(4) (2010) o163-o167
Space group: P 1 21/c 1
Cell volume: 1548.45
Cell parameters: 7.5165; 11.6572; 17.6917; 90; 92.701; 90;  

COD ID: 2017595
CIF file

HKL data

Original IUCr paper

Formula: - C18 H12 N4 O2 -
Comments: Quiroga, Jairo; Trilleras, Jorge; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher A hydrogen-bonded dimer in 6-(4-bromophenyl)-3-methyl-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine and a chain of rings built from N—H···N and C—H···π(pyridine) hydrogen bonds in 3-(4-nitrophenyl)-4-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine Acta Crystallographica Section C 66(4) (2010) o163-o167
Space group: P -1
Cell volume: 747.31
Cell parameters: 7.0408; 9.636; 11.1961; 84.906; 89.177; 81.012;  

COD ID: 2017596
CIF file

HKL data

Original IUCr paper

Formula: - C12 H36 Cl6 N3 Sb -
Comments: Bujak, Maciej Octahedral distortion caused by hydrogen bonding in tris(diethylammonium) hexachloridoantimonate(III) Acta Crystallographica Section C 66(4) (2010) m101-m103
Space group: R 3 c :H
Cell volume: 3559.19
Cell parameters: 14.71917; 14.71917; 18.9694; 90; 90; 120;  

COD ID: 2017597
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 Cl2 N4 O4 -
Comments: Perpétuo, Genivaldo Julio; Janczak, Jan Hydrogen-bonded networks in 5-chloropyridin-2-amine‒fumaric acid (2/1) and 2-aminopyridinium <small>DL</small>-malate Acta Crystallographica Section C 66(4) (2010) o225-o228
Space group: P 1 21/c 1
Cell volume: 798.1
Cell parameters: 13.806; 5.066; 11.705; 90; 102.87; 90;  

COD ID: 2017598
CIF file

HKL data

Original IUCr paper

Formula: - C9 H12 N2 O5 -
Comments: Perpétuo, Genivaldo Julio; Janczak, Jan Hydrogen-bonded networks in 5-chloropyridin-2-amine‒fumaric acid (2/1) and 2-aminopyridinium <small>DL</small>-malate Acta Crystallographica Section C 66(4) (2010) o225-o228
Space group: P 1 21/n 1
Cell volume: 1068.2
Cell parameters: 7.619; 7.473; 19.042; 90; 99.85; 90;  

COD ID: 2017599
CIF file

HKL data

Original IUCr paper

Formula: - C16 H15 N O -
Comments: Gómez, Sandra L.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Five 2-aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: isolated molecules and hydrogen-bonded chains and sheets Acta Crystallographica Section C 66(4) (2010) o233-o240
Space group: C 1 c 1
Cell volume: 2384.4
Cell parameters: 10.7475; 10.7842; 20.5812; 90; 91.688; 90;  

COD ID: 2017600
CIF file

HKL data

Original IUCr paper

Formula: - C16 H14 Cl N O -
Comments: Gómez, Sandra L.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Five 2-aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: isolated molecules and hydrogen-bonded chains and sheets Acta Crystallographica Section C 66(4) (2010) o233-o240
Space group: P 1 21/n 1
Cell volume: 2562.1
Cell parameters: 8.2405; 11.5432; 27.442; 90; 101.03; 90;  

COD ID: 2017601
CIF file

HKL data

Original IUCr paper

Formula: - C17 H17 N O -
Comments: Gómez, Sandra L.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Five 2-aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: isolated molecules and hydrogen-bonded chains and sheets Acta Crystallographica Section C 66(4) (2010) o233-o240
Space group: P 1 21/c 1
Cell volume: 2574.3
Cell parameters: 10.9966; 23.691; 10.6323; 90; 111.661; 90;  

COD ID: 2017602
CIF file

HKL data

Original IUCr paper

Formula: - C16 H14 Br N O -
Comments: Gómez, Sandra L.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Five 2-aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: isolated molecules and hydrogen-bonded chains and sheets Acta Crystallographica Section C 66(4) (2010) o233-o240
Space group: P 21 21 21
Cell volume: 1302.1
Cell parameters: 5.5214; 10.2982; 22.9; 90; 90; 90;  

COD ID: 2017603
CIF file

HKL data

Original IUCr paper

Formula: - C16 H13 Br Cl N O -
Comments: Gómez, Sandra L.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Five 2-aryl-substituted tetrahydro-1,4-epoxy-1-benzazepines: isolated molecules and hydrogen-bonded chains and sheets Acta Crystallographica Section C 66(4) (2010) o233-o240
Space group: P 1 21/c 1
Cell volume: 1390.1
Cell parameters: 15.3626; 11.5436; 7.8832; 90; 96.08; 90;  

COD ID: 2017604
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 F4 N4 O2 -
Comments: Xu, Huan; Mi, Jin-Ling; Hu, Zhao-Jian; Guo, Xiu-Kai; Chen, Qun An ice-like water hexamer with øverline{3} symmetry in the hydrogen-bonded structure of 2,3,5,6-tetrafluoro-1,4-bis(imidazol-1-ylmethyl)benzene dihydrate Acta Crystallographica Section C 66(4) (2010) o151-o153
Space group: R -3 :H
Cell volume: 3482
Cell parameters: 17.753; 17.753; 12.756; 90; 90; 120;  

COD ID: 2017605
CIF file

HKL data

Original IUCr paper

Formula: - C8 H17 N O2 -
Comments: de Sousa, Alvaro S.; Hlam, Zanele; Fernandes, Manuel A.; Marques, Helder M. Hydrogen-bonding controls the solid-state and enantiomeric comformations of the amino alcohol ligand 2-[(2-hydroxyethyl)amino]cyclohexanol Acta Crystallographica Section C 66(4) (2010) o229-o232
Space group: P -1
Cell volume: 883.02
Cell parameters: 9.4334; 10.028; 10.4651; 112.954; 92.429; 102.055;  

COD ID: 2017606
CIF file

HKL data

Original IUCr paper

Formula: - C6 H8 N2 -
Comments: Czapik, Agnieszka; Gdaniec, Maria A new polymorph of benzene-1,2-diamine: isomorphism with 2-aminophenol and two-dimensional isostructurality of polymorphs Acta Crystallographica Section C 66(4) (2010) o198-o201
Space group: P b c a
Cell volume: 1186.2
Cell parameters: 7.533; 7.835; 20.098; 90; 90; 90;  

COD ID: 2017607
CIF file

HKL data

Original IUCr paper

Formula: - C26 H45 N3 O8 -
Comments: Sengar, Raghvendra Singh; Geib, Steven J.; Nigam, Archana; Wiener, Erik C. Tri-<i>tert</i>-butyl 3-oxo-4-oxa-1,8,11-triazaspiro[5.6]dodecane-1,8,11-triacetate Acta Crystallographica Section C 66(4) (2010) o174-o175
Space group: P -1
Cell volume: 2982.6
Cell parameters: 11.1304; 15.25; 18.098; 99.305; 90.01; 100.168;  

COD ID: 2017608
CIF file

HKL data

Original IUCr paper

Formula: - Ca Cs3 Fe O14 P4 -
Comments: Strutynska, Nataliya Yu.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Babaryk, Artem A.; Slobodyanik, Nikolay S. The triple pyrophosphate Cs~3~CaFe(P~2~O~7~)~2~ Acta Crystallographica Section C 66(4) (2010) i39-i41
Space group: P 21 21 21
Cell volume: 1578.54
Cell parameters: 9.3001; 11.2399; 15.101; 90; 90; 90;  

COD ID: 2017609
CIF file

HKL data

Original IUCr paper

Formula: - C10 H14 F N5 O5 -
Comments: Jiang, Dawei; Budow, Simone; Glaçon, Virginie; Eickmeier, Henning; Reuter, Hans; He, Yang; Seela, Frank 2-Amino-8-(2-deoxy-2-fluoro-β-<small>D</small>-arabinofuranosyl)imidazo[1,2-<i>a</i>][1,3,5]triazin-4(8<i>H</i>)-one monohydrate, a 2'-deoxyguanosine analogue with an altered Watson‒Crick recognition site Acta Crystallographica Section C 66(4) (2010) o194-o197
Space group: P 1 21 1
Cell volume: 631.18
Cell parameters: 7.3752; 6.3516; 13.8654; 90; 103.648; 90;  

COD ID: 2017610
CIF file

HKL data

Original IUCr paper

Formula: - C11 H11 N3 O -
Comments: Quiroga, Jairo; Portilla, Jaime; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher 5-Amino-1-benzoyl-3-methylpyrazole: complex sheets built from N—H···N, C—H···O and C—H···π(arene) hydrogen bonds Acta Crystallographica Section C 66(4) (2010) o159-o162
Space group: P 1 21/c 1
Cell volume: 980.9
Cell parameters: 14.7443; 5.7669; 12.0082; 90; 106.119; 90;  

COD ID: 2017611
CIF file

HKL data

Original IUCr paper

Formula: - C18 H16 F N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher A three-dimensional hydrogen-bonded framework in (2<i>S</i>*,4<i>R</i>*)-7-fluoro-2-<i>exo</i>-[(<i>E</i>)-styryl]-2,3,4,5-tetrahydro-1<i>H</i>-1,4-epoxy-1-benzazepine Acta Crystallographica Section C 66(4) (2010) o206-o208
Space group: P 1 21 1
Cell volume: 691
Cell parameters: 10.052; 5.299; 12.976; 90; 91.1; 90;  

COD ID: 2017612
CIF file

HKL data

Original IUCr paper

Formula: - C9 H11 N5 O3 -
Comments: Kline, Paul C.; Zhao, Hongqiu; Noll, Bruce C.; Oliver, Allen G.; Serianni, Anthony S. 1-(β-<small>D</small>-Erythrofuranosyl)adenosine Acta Crystallographica Section C 66(4) (2010) o215-o218
Space group: P 21 21 21
Cell volume: 2004
Cell parameters: 4.793; 11.365; 36.79; 90; 90; 90;  

COD ID: 2017613
CIF file

HKL data

Original IUCr paper

Formula: - C5 H10 Cl N3 -
Comments: Guzei, Ilia A.; Spencer, Lara C.; Ainooson, Michael K.; Darkwa, James Constructor graph description of the hydrogen-bonding supramolecular assembly in two ionic compounds: 2-(pyrazol-1-yl)ethylammonium chloride and diaquadichloridobis(2-hydroxyethylammonium)cobalt(II) dichloride Acta Crystallographica Section C 66(4) (2010) m89-m96
Space group: P 21 21 21
Cell volume: 714.15
Cell parameters: 6.9634; 9.3732; 10.9416; 90; 90; 90;  

COD ID: 2017614
CIF file

HKL data

Original IUCr paper

Formula: - C4 H20 Cl4 Co N2 O4 -
Comments: Guzei, Ilia A.; Spencer, Lara C.; Ainooson, Michael K.; Darkwa, James Constructor graph description of the hydrogen-bonding supramolecular assembly in two ionic compounds: 2-(pyrazol-1-yl)ethylammonium chloride and diaquadichloridobis(2-hydroxyethylammonium)cobalt(II) dichloride Acta Crystallographica Section C 66(4) (2010) m89-m96
Space group: P -1
Cell volume: 344.9
Cell parameters: 6.258; 6.653; 8.369; 83.57; 86.37; 86.19;  

COD ID: 2017615
CIF file

HKL data

Original IUCr paper

Formula: - Cu3.12 O16 P4 Sr2.88 -
Comments: Karanović, Ljiljana; Šutović, Sabina; Poleti, Dejan; Dordević, Tamara; Pačevski, Aleksandar Substitutional and positional disorder in Sr~2.88~Cu~3.12~(PO~4~)~4~ Acta Crystallographica Section C 66(4) (2010) i42-i44
Space group: P 1 21/n 1
Cell volume: 684.7
Cell parameters: 9.2077; 4.9369; 15.074; 90; 92.15; 90;  

COD ID: 2017616
CIF file

HKL data

Original IUCr paper

Formula: - C15 H12 Mn N2 O7 -
Comments: Chen, Hong-Feng; Fang, Qi; Chen, Hong-Yu; Yu, Wen-Tao; Weng, Lin-Hong Poly[[[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-croconato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] monohydrate]: a one-dimensional coordination polymer connected by hydrophilic‒hydrophilic and lipophilic‒lipophilic interactions at 135K Acta Crystallographica Section C 66(4) (2010) m97-m100
Space group: P 1 21/c 1
Cell volume: 1477.84
Cell parameters: 11.3363; 9.3622; 14.4053; 90; 104.846; 90;  

COD ID: 2017617
CIF file

HKL data

Original IUCr paper

Formula: - C15 H12 Mn N2 O7 -
Comments: Chen, Hong-Feng; Fang, Qi; Chen, Hong-Yu; Yu, Wen-Tao; Weng, Lin-Hong Poly[[[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-croconato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] monohydrate]: a one-dimensional coordination polymer connected by hydrophilic‒hydrophilic and lipophilic‒lipophilic interactions at 135K Acta Crystallographica Section C 66(4) (2010) m97-m100
Space group: P 1 21/c 1
Cell volume: 1495.26
Cell parameters: 11.3911; 9.4023; 14.4361; 90; 104.74; 90;  

COD ID: 2017618
CIF file

HKL data

Original IUCr paper

Formula: - C30 H30 N2 O6 Si -
Comments: Böhme, Uwe; Fels, Sabine Pentacoordination <i>versus</i> tetracoordination in silicon derivatives of an <i>O</i>,<i>N</i>,<i>O</i>'-tridentate ligand Acta Crystallographica Section C 66(4) (2010) o202-o205
Space group: P 1 21/n 1
Cell volume: 2843.5
Cell parameters: 16.5171; 10.4952; 18.2931; 90; 116.272; 90;  

COD ID: 2017619
CIF file

HKL data

Original IUCr paper

Formula: - C16 H17 N O3 Si -
Comments: Böhme, Uwe; Fels, Sabine Pentacoordination <i>versus</i> tetracoordination in silicon derivatives of an <i>O</i>,<i>N</i>,<i>O</i>'-tridentate ligand Acta Crystallographica Section C 66(4) (2010) o202-o205
Space group: P 1 21/c 1
Cell volume: 1495.61
Cell parameters: 9.0207; 12.8134; 12.9427; 90; 91.303; 90;  

COD ID: 2017620
CIF file

HKL data

Original IUCr paper

Formula: - C39.57 H43.05 Cu2 Fe2.84 N2 O10 -
Comments: Luo, Jian-Hai; Huang, Chang-Cang; Huang, Xi-He; Wang, Jin-Gen μ~2~-Acetato-κ^2^<i>O</i>:<i>O</i>'-tris(μ~2~-ferrocenecarboxylato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)]. Corrigendum Acta Crystallographica Section C 66(4) (2010) e11-e12
Space group: P -1
Cell volume: 2032.3
Cell parameters: 10.948; 13.548; 15.828; 108.96; 94.57; 110.33;  

COD ID: 2017621
CIF file

HKL data

Original IUCr paper

Formula: - C9 H11 N O4 S -
Comments: Kociok-Köhn, Gabriele; Lewis, Simon E. Crystallographic rationalization of the reactivity and spectroscopic properties of (2<i>R</i>)-<i>S</i>-(2,5-dihydroxyphenyl)cysteine Acta Crystallographica Section C 66(4) (2010) o187-o189
Space group: P 21 21 21
Cell volume: 982.92
Cell parameters: 5.1661; 10.3981; 18.2979; 90; 90; 90;  

COD ID: 2017622
CIF file

HKL data

Original IUCr paper

Formula: - C32 H52 N2 -
Comments: Mudianta, I. Wayan; Garson, Mary J.; Bernhardt, Paul V. The 293K structure of tetradehydrohaliclonacyclamine A Acta Crystallographica Section C 66(4) (2010) o176-o178
Space group: P 2 21 21
Cell volume: 2952.47
Cell parameters: 9.8895; 16.1689; 18.4642; 90; 90; 90;  

COD ID: 2017623
CIF file

HKL data

Original IUCr paper

Formula: - C36 H31 Cd Cl2 N6 O11.5 -
Comments: Sun, Yu-Hui; Du, Zi-Yi; Zhang, Shi-Yong; He, Yan-Fang; Zhou, Zhong-Gao Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) bis(perchlorate) 3.5-hydrate: a water chain stabilized by perchlorate anions Acta Crystallographica Section C 66(4) (2010) m104-m106
Space group: C 1 2/c 1
Cell volume: 7441.5
Cell parameters: 28.1954; 19.6534; 15.7245; 90; 121.348; 90;  

COD ID: 2017624
CIF file

Original IUCr paper

Formula: - C4 H10 Br2 Cu N10 -
Comments: Ivashkevich, Ludmila S.; Lyakhov, Alexander S.; Mosalkova, Anastasiya P.; Gaponik, Pavel N.; Ivashkevich, Oleg A. Copper(II) chloride and bromide complexes with 2-methyl-2<i>H</i>-tetrazol-5-amine: an X-ray powder diffraction study Acta Crystallographica Section C 66(4) (2010) m114-m117
Space group: P -1
Cell volume: 298.562
Cell parameters: 5.22187; 6.5081; 9.1165; 99.0064; 102.448; 90.2997;  

COD ID: 2017625
CIF file

Original IUCr paper

Formula: - C4 H10 Cl2 Cu N10 -
Comments: Ivashkevich, Ludmila S.; Lyakhov, Alexander S.; Mosalkova, Anastasiya P.; Gaponik, Pavel N.; Ivashkevich, Oleg A. Copper(II) chloride and bromide complexes with 2-methyl-2<i>H</i>-tetrazol-5-amine: an X-ray powder diffraction study Acta Crystallographica Section C 66(4) (2010) m114-m117
Space group: P -1
Cell volume: 282.813
Cell parameters: 5.16248; 6.32103; 8.9925; 100.165; 101.454; 90.4234;  

COD ID: 2017626
CIF file

HKL data

Original IUCr paper

Formula: - C11 H19 N4 O4 P -
Comments: Hazra, Dipak K.; Chatterjee, Rajarshi; Ali, Mahammad; Mukherjee, Monika 4-(3,5-Dimethyl-1<i>H</i>-pyrazol-4-ylmethyl)-3,5-dimethyl-1<i>H</i>-pyrazol-2-ium dihydrogen phosphate: a combined X-ray and DFT study Acta Crystallographica Section C 66(4) (2010) o190-o193
Space group: P -1
Cell volume: 706.4
Cell parameters: 7.649; 10.504; 10.538; 117.624; 104.576; 94.663;  

COD ID: 2017627
CIF file

HKL data

Original IUCr paper

Formula: - C14 H24 Si2 -
Comments: Meyer-Wegner, Frank; Lerner, Hans-Wolfram; Bolte, Michael C—H···π interactions in cocrystals of bis(trimethylsilyl)acetylene and diphenylacetylene with benzene Acta Crystallographica Section C 66(4) (2010) o182-o184
Space group: C 1 2/m 1
Cell volume: 821.82
Cell parameters: 14.0831; 10.6487; 5.7225; 90; 106.739; 90;  

COD ID: 2017628
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 -
Comments: Meyer-Wegner, Frank; Lerner, Hans-Wolfram; Bolte, Michael C—H···π interactions in cocrystals of bis(trimethylsilyl)acetylene and diphenylacetylene with benzene Acta Crystallographica Section C 66(4) (2010) o182-o184
Space group: P 1 21/c 1
Cell volume: 735.66
Cell parameters: 5.7078; 9.0681; 14.4212; 90; 99.741; 90;  

COD ID: 2017629
CIF file

HKL data

Original IUCr paper

Formula: - C23 H26 Cl N3 O2 -
Comments: López, Gerson; Jaramillo, L. Marina; Abonia, Rodrigo; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in three substituted <i>N</i>-benzyl-<i>N</i>-(3-<i>tert</i>-butyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)acetamides Acta Crystallographica Section C 66(4) (2010) o168-o173
Space group: P -1
Cell volume: 1043.4
Cell parameters: 10.0761; 10.5208; 11.1868; 96.546; 95.79; 116.035;  

COD ID: 2017630
CIF file

HKL data

Original IUCr paper

Formula: - C22 H23 Cl2 N3 O -
Comments: López, Gerson; Jaramillo, L. Marina; Abonia, Rodrigo; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in three substituted <i>N</i>-benzyl-<i>N</i>-(3-<i>tert</i>-butyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)acetamides Acta Crystallographica Section C 66(4) (2010) o168-o173
Space group: P 1 21/c 1
Cell volume: 2091.2
Cell parameters: 10.12; 10.7732; 19.2751; 90; 95.662; 90;  

COD ID: 2017631
CIF file

HKL data

Original IUCr paper

Formula: - C26 H31 N3 O2 S2 -
Comments: López, Gerson; Jaramillo, L. Marina; Abonia, Rodrigo; Cobo, Justo; Glidewell, Christopher Hydrogen-bonding patterns in three substituted <i>N</i>-benzyl-<i>N</i>-(3-<i>tert</i>-butyl-1-phenyl-1<i>H</i>-pyrazol-5-yl)acetamides Acta Crystallographica Section C 66(4) (2010) o168-o173
Space group: P -1
Cell volume: 1258.5
Cell parameters: 9.6847; 11.3127; 12.3425; 77.04; 72.789; 84.977;  

COD ID: 2017632
CIF file

HKL data

Original IUCr paper

Formula: - C16 H21 Cl N6 O -
Comments: Quiroga, Jairo; Trilleras, Jorge; Cobo, Justo; Glidewell, Christopher 2-Amino-4-(piperidin-1-yl)-11<i>H</i>-pyrimido[4,5-<i>b</i>][1,5]benzodiazepin-6-ium chloride monohydrate and 2-amino-4-[methyl(2-methylphenyl)amino]-11<i>H</i>-pyrimido[4,5-<i>b</i>][1,5]benzodiazepin-6-ium chloride‒benzene-1,2-diamine (1/1): complex sheets generated by multiple hydrogen bonds Acta Crystallographica Section C 66(4) (2010) o154-o158
Space group: P 1 21/n 1
Cell volume: 1582.4
Cell parameters: 13.7831; 7.5324; 15.2987; 90; 94.925; 90;  

COD ID: 2017633
CIF file

HKL data

Original IUCr paper

Formula: - C25 H27 Cl N8 -
Comments: Quiroga, Jairo; Trilleras, Jorge; Cobo, Justo; Glidewell, Christopher 2-Amino-4-(piperidin-1-yl)-11<i>H</i>-pyrimido[4,5-<i>b</i>][1,5]benzodiazepin-6-ium chloride monohydrate and 2-amino-4-[methyl(2-methylphenyl)amino]-11<i>H</i>-pyrimido[4,5-<i>b</i>][1,5]benzodiazepin-6-ium chloride‒benzene-1,2-diamine (1/1): complex sheets generated by multiple hydrogen bonds Acta Crystallographica Section C 66(4) (2010) o154-o158
Space group: P -1
Cell volume: 1149
Cell parameters: 10.9559; 11.2372; 11.432; 102.894; 112.176; 107.512;  

COD ID: 2017634
CIF file

HKL data

Original IUCr paper

Formula: - C20 H42 N8 O -
Comments: Rivera, Augusto; Ríos-Motta, Jaime; Dušek, Michal; Jarošová, Markéta Unexpected conformational consequences of weak hydrogen bonds on 1,3,7,9,13,15,19,21-octaazapentacyclo[19.3.1.1^3,7^.1^9,13^.1^15,19^]octacosane monohydrate Acta Crystallographica Section C 66(4) (2010) o222-o224
Space group: P 1 21/c 1
Cell volume: 2293.58
Cell parameters: 12.4858; 18.8016; 9.8354; 90; 96.601; 90;  

COD ID: 2017635
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 Cl N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P 1 21/c 1
Cell volume: 1214.2
Cell parameters: 5.6445; 25.744; 8.3894; 90; 95.124; 90;  

COD ID: 2017636
CIF file

HKL data

Original IUCr paper

Formula: - C15 H18 Cl N O -
Comments: Acosta, Lina M.; Palma, Alirio; Bahsas, Ali; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded dimers, chains and rings in six differently substituted 2-vinyltetrahydro-1,4-epoxy-1-benzazepines Acta Crystallographica Section C 66(4) (2010) o209-o214
Space group: P -1
Cell volume: 656.7
Cell parameters: 5.289; 9.3076; 13.551; 94.554; 94.684; 97.298;  

COD ID: 2017637
CIF file

HKL data

Original IUCr paper

Formula: - C19 H26 O2 -
Comments: Andrade, L. C. R.; de Almeida, M. J. M.; Neves, M. A. C.; Dinis, T. C. P.; Sá e Melo, M. L. 6β-Methyl-<i>B</i>-norandrostenedione Acta Crystallographica Section C 66(4) (2010) o185-o186
Space group: P 1 21 1
Cell volume: 831.9
Cell parameters: 6.2; 10.89; 12.53; 90; 100.49; 90;  

COD ID: 2017638
CIF file

HKL data

Original IUCr paper

Formula: - C12 H30 Co N11 O9 -
Comments: Schönleber, Andreas; van Smaalen, Sander; Larsen, Finn Krebs Orientational disorder in Λ-cobalt(III) sepulchrate trinitrate Acta Crystallographica Section C 66(4) (2010) m107-m109
Space group: P 63 2 2
Cell volume: 994.8
Cell parameters: 8.4945; 8.4945; 15.9195; 90; 90; 120;  

COD ID: 2017639
CIF file

HKL data

Original IUCr paper

Formula: - Al13.92 Ba8 La26.32 O167.04 Ru18.08 Sr53.68 -
Comments: Zúñiga, F. J.; García-García, F. J.; Hoelzel, M.; Reller, A. Al~14~Ba~8~La~26.3~Ru~18~Sr~53.7~O~167~: a variant of cubic perovskite with isolated RuO~6~ units Acta Crystallographica Section C 66(5) (2010) i50-i54
Space group: F 2 3
Cell volume: 4249.2
Cell parameters: 16.197; 16.197; 16.197; 90; 90; 90;  

COD ID: 2017640
CIF file

Original IUCr paper

Formula: - Al13.984 Ba8 La26.424 O167.193 Ru18.02 Sr53.64 -
Comments: Zúñiga, F. J.; García-García, F. J.; Hoelzel, M.; Reller, A. Al~14~Ba~8~La~26.3~Ru~18~Sr~53.7~O~167~: a variant of cubic perovskite with isolated RuO~6~ units Acta Crystallographica Section C 66(5) (2010) i50-i54
Space group: F 2 3
Cell volume: 4249.2
Cell parameters: 16.197; 16.197; 16.197; 90; 90; 90;  

COD ID: 2017641
CIF file

HKL data

Original IUCr paper

Formula: - H5.2 N1.2 O8.8 P2 Zn3 -
Comments: Stojanović, Jovica; Dordević, Tamara; Karanović, Ljiljana [Zn~3~(PO~4~)~2~(H~2~O)~0.8~(NH~3~)~1.2~] Acta Crystallographica Section C 66(5) (2010) i55-i57
Space group: C 1 2/c 1
Cell volume: 897.2
Cell parameters: 16.932; 5.0171; 10.564; 90; 91.27; 90;  

COD ID: 2017642
CIF file

HKL data

Original IUCr paper

Formula: - C43 H32 Au2 F6 O5 P2 -
Comments: Tunyogi, Tünde; Deák, Andrea [μ-4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]bis[(trifluoroacetato)gold(I)] and its dichloromethane 0.58-solvate Acta Crystallographica Section C 66(5) (2010) m133-m136
Space group: P -1
Cell volume: 2090
Cell parameters: 10.2311; 13.041; 17.344; 73.969; 88.123; 70.353;  

COD ID: 2017643
CIF file

HKL data

Original IUCr paper

Formula: - C43.58 H33.16 Au2 Cl1.15 F6 O5 P2 -
Comments: Tunyogi, Tünde; Deák, Andrea [μ-4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]bis[(trifluoroacetato)gold(I)] and its dichloromethane 0.58-solvate Acta Crystallographica Section C 66(5) (2010) m133-m136
Space group: P 1 21/c 1
Cell volume: 4370
Cell parameters: 10.548; 17.028; 24.724; 90; 100.253; 90;  

COD ID: 2017644
CIF file

HKL data

Original IUCr paper

Formula: - C15 H F9 O2 -
Comments: Hori, Akiko; Naganuma, Kohei Fully and partially fluorinated flavone derivatives Acta Crystallographica Section C 66(5) (2010) o256-o259
Space group: P 1 21/n 1
Cell volume: 1322.9
Cell parameters: 6.2221; 25.234; 8.4624; 90; 95.355; 90;  

COD ID: 2017645
CIF file

HKL data

Original IUCr paper

Formula: - C15 H6 F4 O2 -
Comments: Hori, Akiko; Naganuma, Kohei Fully and partially fluorinated flavone derivatives Acta Crystallographica Section C 66(5) (2010) o256-o259
Space group: P 1 21/n 1
Cell volume: 1163.8
Cell parameters: 7.54; 6.4742; 23.92; 90; 94.635; 90;  

COD ID: 2017646
CIF file

HKL data

Original IUCr paper

Formula: - C18 H15 Cl2 Sb -
Comments: MacDonald, Daniel J.; Jennings, Michael C.; Preuss, Kathryn E. A new polymorph of dichloridotriphenylantimony Acta Crystallographica Section C 66(5) (2010) m137-m140
Space group: P 1 c 1
Cell volume: 1665.33
Cell parameters: 13.8005; 10.0348; 13.4973; 90; 117.008; 90;  

COD ID: 2017647
CIF file

HKL data

Original IUCr paper

Formula: - C28 H24 Cd Cl2 N8 O4 S2 -
Comments: Wang, Yu-Bo; Pan, Tong-Hen; Liang, Qian; Liu, Dong-Sheng; Huang, Chang-Cang Poly[bis(μ-4-benzoyl-1-isonicotinoylthiosemicarbazide-κ^2^<i>N</i>:<i>S</i>)dichloridocadmium(II)] Acta Crystallographica Section C 66(5) (2010) m127-m129
Space group: C 1 2/c 1
Cell volume: 3043.4
Cell parameters: 26.272; 8.8773; 14.453; 90; 115.46; 90;  

COD ID: 2017648
CIF file

HKL data

Original IUCr paper

Formula: - Cr O4 Tl2 -
Comments: Fábry, Jan; Dušek, Michal; Fejfarová, Karla; Krupková, Radmila; Vaněk, Přemysl A new modification of thallium chromate related to the β-K~2~SO~4~ family Acta Crystallographica Section C 66(5) (2010) i45-i49
Space group: C 1 2/m 1
Cell volume: 999.06
Cell parameters: 12.7458; 5.807; 14.721; 90; 113.519; 90;  

COD ID: 2017649
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 Br N3 O9 -
Comments: Smith, Graham; Cotton, Marcus S.; Wermuth, Urs D.; Boyd, Sue E. Crystallographic characterization of the first reported crystalline form of the potent hallucinogen (<i>R</i>)-2-amino-1-(8-bromobenzo[1,2-<i>b</i>;5,4-<i>b</i>']difuran-4-yl)propane or `bromodragonfly': the 1:1 anhydrous proton-transfer compound with 3,5-dinitrosalicylic acid Acta Crystallographica Section C 66(5) (2010) o252-o255
Space group: P 1 21 1
Cell volume: 1016.34
Cell parameters: 6.9596; 17.2201; 8.7147; 90; 103.315; 90;  

COD ID: 2017650
CIF file

HKL data

Original IUCr paper

Formula: - C7 H3 F2 N2 S2 -
Comments: Fatila, Elisabeth M.; Jennings, Michael C.; Goodreid, Jordan; Preuss, Kathryn E. A third polymorph of 4-(2,6-difluorophenyl)-1,2,3,5-dithiadiazolyl Acta Crystallographica Section C 66(5) (2010) o260-o264
Space group: P 1 21/c 1
Cell volume: 1600.32
Cell parameters: 10.3839; 7.9745; 20.5463; 90; 109.846; 90;  

COD ID: 2017651
CIF file

HKL data

Original IUCr paper

Formula: - C12 H16 F6 N2 O4 V2 -
Comments: Aldous, David W.; Slawin, Alexandra M. Z.; Lightfoot, Philip A new chain structure: <i>catena</i>-poly[4,4'-(ethane-1,2-diyl)dipyridinium bis[[aquadifluoridooxidovanadate]-μ-fluorido]] Acta Crystallographica Section C 66(5) (2010) m130-m132
Space group: P -1
Cell volume: 390.3
Cell parameters: 3.7797; 10.362; 11.297; 62.92; 82.3; 87.6;  

COD ID: 2017652
CIF file

HKL data

Original IUCr paper

Formula: - C22 H21 Cl N4 O -
Comments: Quiroga, Jairo; Trilleras, Jorge; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher (<i>E</i>)-<i>N</i>^2^-{4-[(<i>E</i>)-2-(4-Chlorobenzoyl)ethenyl]-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-yl}-<i>N</i>^1^,<i>N</i>^1^-dimethylformamidine: polarized molecules within sheets of π-stacked hydrogen-bonded chains Acta Crystallographica Section C 66(5) (2010) o245-o248
Space group: P 21 21 21
Cell volume: 1970.99
Cell parameters: 8.2228; 8.3506; 28.7043; 90; 90; 90;  

COD ID: 2017653
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 F N5 O3 -
Comments: Cheung, Eugene Y.; Peterson, Matthew L.; Chiarella, Renato; Foxman, Bruce M. A novel oxazolidinone antibiotic: RWJ-416457 Acta Crystallographica Section C 66(5) (2010) o249-o251
Space group: P 1 21 1
Cell volume: 858.8
Cell parameters: 4.8358; 10.293; 17.403; 90; 97.524; 90;  

COD ID: 2017654
CIF file

Original IUCr paper

Formula: - C20 H18 N2 Ni O6 -
Comments: Wang, Suna; Wang, Daqi; Dou, Jianmin; Li, Dacheng An unusual three-dimensional chiral threefold polycatenating network self-assembled from inclined two-dimensional (4,4) layer motifs Acta Crystallographica Section C 66(5) (2010) m141-m144
Space group: P 32
Cell volume: 1482
Cell parameters: 11.261; 11.261; 13.495; 90; 90; 120;  

COD ID: 2017655
CIF file

HKL data

Original IUCr paper

Formula: - Cu2 Se3 Sn -
Comments: Gulay, L. D.; Daszkiewicz, M.; Ostapyuk, T. A.; Klymovych, O. S.; Zmiy, O. F. Monoclinic Cu~2~Se~3~Sn Acta Crystallographica Section C 66(5) (2010) i58-i60
Space group: C 1 c 1
Cell volume: 2211.7
Cell parameters: 6.9612; 12.043; 26.481; 90; 94.97; 90;  

COD ID: 2017656
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N4 O2 -
Comments: Lee, Gene-Hsiang Hydrogen-bonded supramolecular networks of <i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide and 4,4'-{[oxalylbis(azanediyl)]dimethylene}dipyridinium dinitrate Acta Crystallographica Section C 66(5) (2010) o241-o244
Space group: P 1 21/c 1
Cell volume: 650.99
Cell parameters: 4.7578; 13.8845; 10.1331; 90; 103.465; 90;  

COD ID: 2017657
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 N6 O8 -
Comments: Lee, Gene-Hsiang Hydrogen-bonded supramolecular networks of <i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide and 4,4'-{[oxalylbis(azanediyl)]dimethylene}dipyridinium dinitrate Acta Crystallographica Section C 66(5) (2010) o241-o244
Space group: P 1 21/c 1
Cell volume: 852.72
Cell parameters: 5.3668; 10.7271; 14.8628; 90; 94.746; 90;  

COD ID: 2017658
CIF file

HKL data

Original IUCr paper

Formula: - C21 H23 Cl N2 O2 -
Comments: Dutkiewicz, Grzegorz; Yathirajan, H. S.; Ramachandran, R.; Kabilan, S.; Kubicki, Maciej Different hydrogen-bonding modes in two closely related oximes Acta Crystallographica Section C 66(6) (2010) o274-o278
Space group: C 1 2/c 1
Cell volume: 3777.6
Cell parameters: 34.176; 9.1227; 12.1235; 90; 91.962; 90;  

COD ID: 2017659
CIF file

HKL data

Original IUCr paper

Formula: - C21 H23 Cl N2 O2 -
Comments: Dutkiewicz, Grzegorz; Yathirajan, H. S.; Ramachandran, R.; Kabilan, S.; Kubicki, Maciej Different hydrogen-bonding modes in two closely related oximes Acta Crystallographica Section C 66(6) (2010) o274-o278
Space group: C 1 2/c 1
Cell volume: 3656.2
Cell parameters: 33.849; 9.025; 11.98; 90; 92.51; 90;  

COD ID: 2017660
CIF file

HKL data

Original IUCr paper

Formula: - C22 H25 Cl N2 O2 -
Comments: Dutkiewicz, Grzegorz; Yathirajan, H. S.; Ramachandran, R.; Kabilan, S.; Kubicki, Maciej Different hydrogen-bonding modes in two closely related oximes Acta Crystallographica Section C 66(6) (2010) o274-o278
Space group: P 1 21/n 1
Cell volume: 1995.8
Cell parameters: 9.469; 16.658; 12.653; 90; 90.29; 90;  

COD ID: 2017661
CIF file

HKL data

Original IUCr paper

Formula: - C100 H110 Cu5 O20 -
Comments: Ho, Douglas M. Bis(hinokitiolato)copper(II): modification (III) Acta Crystallographica Section C 66(6) (2010) m145-m148
Space group: P -1
Cell volume: 2268.5
Cell parameters: 9.6263; 12.8911; 19.4499; 72.847; 79.812; 88.897;  

COD ID: 2017662
CIF file

Original IUCr paper

Formula: - C23 H26 Br N3 O4 -
Comments: Nichol, Gary S.; Murigi, Francis N.; Mash, Eugene A. A synchrotron study of (2<i>R</i>,5'<i>S</i>)-5'-benzyl-5-bromo-6-methoxyspiro[indane-2,2'-piperazine]-3',6'-dione dimethylformamide solvate Acta Crystallographica Section C 66(6) (2010) o302-o304
Space group: P 21 21 21
Cell volume: 2191.1
Cell parameters: 6.0741; 13.8336; 26.076; 90; 90; 90;  

COD ID: 2017663
CIF file

HKL data

Original IUCr paper

Formula: - As2 O6 Zn3 -
Comments: Harrison, William T. A. β-Zn~3~(AsO~3~)~2~ Acta Crystallographica Section C 66(6) (2010) i64-i66
Space group: P 1 21/c 1
Cell volume: 669.71
Cell parameters: 8.2438; 5.1781; 15.8222; 90; 97.445; 90;  

COD ID: 2017664
CIF file

HKL data

Original IUCr paper

Formula: - C17 H28 N7 O12 P -
Comments: Ślepokura, Katarzyna; Petrus, Rafał Nucleotide‒amino acid interactions in the <small>L</small>-His‒IMP·MeOH·H~2~O complex Acta Crystallographica Section C 66(6) (2010) o265-o269
Space group: P 1 21 1
Cell volume: 1136.2
Cell parameters: 14.195; 4.816; 17.029; 90; 102.58; 90;  

COD ID: 2017665
CIF file

HKL data

Original IUCr paper

Formula: - Ag2.535 Mo12 Se15 Tl2 -
Comments: Gougeon, P.; Gall, P.; Gautier, R.; Potel, M. Ag~2.54~Tl~2~Mo~12~Se~15~: a new structure type containing Mo~6~ and Mo~9~ clusters Acta Crystallographica Section C 66(6) (2010) i67-i70
Space group: P -3
Cell volume: 1344.47
Cell parameters: 9.9962; 9.9962; 15.5364; 90; 90; 120;  

COD ID: 2017666
CIF file

HKL data

Original IUCr paper

Formula: - C12 H13 N4 O4.5 -
Comments: Portalone, Gustavo Supramolecular association in proton-transfer adducts containing benzamidinium cations. I. Four molecular salts with uracil derivatives Acta Crystallographica Section C 66(6) (2010) o295-o301
Space group: C 1 2/c 1
Cell volume: 2534.41
Cell parameters: 27.2046; 7.3566; 12.6687; 90; 91.621; 90;  

COD ID: 2017667
CIF file

HKL data

Original IUCr paper

Formula: - C12 H18 N4 O7 -
Comments: Portalone, Gustavo Supramolecular association in proton-transfer adducts containing benzamidinium cations. I. Four molecular salts with uracil derivatives Acta Crystallographica Section C 66(6) (2010) o295-o301
Space group: P 1 21/n 1
Cell volume: 1525.84
Cell parameters: 11.3562; 6.0402; 22.3763; 90; 96.221; 90;  

COD ID: 2017668
CIF file

HKL data

Original IUCr paper

Formula: - C11 H15 N5 O7 -
Comments: Portalone, Gustavo Supramolecular association in proton-transfer adducts containing benzamidinium cations. I. Four molecular salts with uracil derivatives Acta Crystallographica Section C 66(6) (2010) o295-o301
Space group: P 1 21/n 1
Cell volume: 1479.46
Cell parameters: 10.7607; 5.0998; 27.2412; 90; 98.2485; 90;  

COD ID: 2017669
CIF file

HKL data

Original IUCr paper

Formula: - C11 H11 N5 O4 -
Comments: Portalone, Gustavo Supramolecular association in proton-transfer adducts containing benzamidinium cations. I. Four molecular salts with uracil derivatives Acta Crystallographica Section C 66(6) (2010) o295-o301
Space group: P -1
Cell volume: 615.13
Cell parameters: 4.3625; 10.4461; 13.8556; 78.551; 86.841; 84.051;  

COD ID: 2017670
CIF file

HKL data

Original IUCr paper

Formula: - C18 H26 N4 O4 -
Comments: Ejsmont, Krzysztof; Boeglin, Joel; Didierjean, Claude; Guichard, Gilles; Jelsch, Christian 5-(3,4-Dimethoxybenzyl)-7-isopropyl-1,3,5-triazepane-2,6-dione acetonitrile solvate refined using a multipolar atom model Acta Crystallographica Section C 66(6) (2010) o292-o294
Space group: P 21 21 21
Cell volume: 1881.94
Cell parameters: 7.009; 10.504; 25.562; 90; 90; 90;  

COD ID: 2017671
CIF file

HKL data

Original IUCr paper

Formula: - C10 H22 Mg N4 O16 P4 -
Comments: Freire, Eleonora; Vega, Daniel R.; Baggio, Ricardo Zoledronate complexes. III. Two zoledronate complexes with alkaline earth metals: [Mg(C~5~H~9~N~2~O~7~P~2~)~2~(H~2~O)~2~] and [Ca(C~5~H~8~N~2~O~7~P~2~)(H~2~O)]~<i>n~</i> Acta Crystallographica Section C 66(6) (2010) m166-m170
Space group: P -1
Cell volume: 537
Cell parameters: 7.468; 8.439; 9.819; 105.11; 111.98; 97.04;  

COD ID: 2017672
CIF file

HKL data

Original IUCr paper

Formula: - C5 H10 Ca N2 O8 P2 -
Comments: Freire, Eleonora; Vega, Daniel R.; Baggio, Ricardo Zoledronate complexes. III. Two zoledronate complexes with alkaline earth metals: [Mg(C~5~H~9~N~2~O~7~P~2~)~2~(H~2~O)~2~] and [Ca(C~5~H~8~N~2~O~7~P~2~)(H~2~O)]~<i>n~</i> Acta Crystallographica Section C 66(6) (2010) m166-m170
Space group: P 1 21/c 1
Cell volume: 1059.4
Cell parameters: 13.7027; 7.0429; 11.004; 90; 94.007; 90;  

COD ID: 2017673
CIF file

HKL data

Original IUCr paper

Formula: - C31 H30 N2 -
Comments: Howard, Ruth H.; Theobald, Nicola; Bochmann, Manfred; Wright, Joseph A. 1-[2-(2,6-Diisopropylanilino)-1-naphthyl]isoquinoline Acta Crystallographica Section C 66(6) (2010) o310-o312
Space group: P 21 21 21
Cell volume: 2446.7
Cell parameters: 9.0996; 11.2154; 23.974; 90; 90; 90;  

COD ID: 2017674
CIF file

HKL data

Original IUCr paper

Formula: - C16 H14 F6 N2 O2 -
Comments: Lu, Norman; Tu, Wen-Han; Wu, Zong-Wei; Wen, Yuh-Sheng; Liu, Ling-Kang 4,4'-Bis(2,2,2-trifluoroethoxymethyl)-2,2'-bipyridine Acta Crystallographica Section C 66(6) (2010) o289-o291
Space group: P 1 21/n 1
Cell volume: 782.91
Cell parameters: 12.9726; 4.7485; 14.1782; 90; 116.309; 90;  

COD ID: 2017675
CIF file

HKL data

Original IUCr paper

Formula: - C19 H20 Cl N O -
Comments: Yepes, Andrés F.; Jaimes, Ederson; Bahsas, Ali; Palma, Alirio; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher Ring conformations and intermolecular interactions in two fused dibenzoazocines Acta Crystallographica Section C 66(6) (2010) o284-o288
Space group: P 1 21/c 1
Cell volume: 1595.97
Cell parameters: 8.3396; 21.7131; 9.201; 90; 106.683; 90;  

COD ID: 2017676
CIF file

HKL data

Original IUCr paper

Formula: - C23 H23 N O -
Comments: Yepes, Andrés F.; Jaimes, Ederson; Bahsas, Ali; Palma, Alirio; Hursthouse, Michael B.; Cobo, Justo; Glidewell, Christopher Ring conformations and intermolecular interactions in two fused dibenzoazocines Acta Crystallographica Section C 66(6) (2010) o284-o288
Space group: P 1 21/c 1
Cell volume: 1754.57
Cell parameters: 18.9549; 9.8917; 9.4354; 90; 97.348; 90;  

COD ID: 2017677
CIF file

HKL data

Original IUCr paper

Formula: - C27 H17 N3 O2 -
Comments: Díaz, Yurina; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Two similarly substituted benzo[<i>h</i>]pyrazolo[3,4-<i>b</i>]quinoline-5,6(10<i>H</i>)-diones: supramolecular structures in two and three dimensions Acta Crystallographica Section C 66(6) (2010) o305-o309
Space group: P 1 21/c 1
Cell volume: 1900.9
Cell parameters: 15.436; 13.622; 9.359; 90; 105; 90;  

COD ID: 2017678
CIF file

HKL data

Original IUCr paper

Formula: - C28 H19 N3 O2 -
Comments: Díaz, Yurina; Quiroga, Jairo; Cobo, Justo; Glidewell, Christopher Two similarly substituted benzo[<i>h</i>]pyrazolo[3,4-<i>b</i>]quinoline-5,6(10<i>H</i>)-diones: supramolecular structures in two and three dimensions Acta Crystallographica Section C 66(6) (2010) o305-o309
Space group: P -1
Cell volume: 1033.9
Cell parameters: 8.9952; 9.6201; 12.537; 98.72; 103.31; 95.48;  

COD ID: 2017679
CIF file

HKL data

Original IUCr paper

Formula: - C20 H17 N3 -
Comments: Barceló-Oliver, Miquel; Terrón, Angel; García-Raso, Angel; Lah, Nina; Turel, Iztok Intermolecular C—H···π interactions in 1,5-diphenyl-3-(2-pyridyl)-2-pyrazoline Acta Crystallographica Section C 66(6) (2010) o313-o316
Space group: P 1 21/c 1
Cell volume: 1612.46
Cell parameters: 13.2312; 10.4394; 11.7282; 90; 95.518; 90;  

COD ID: 2017680
CIF file

HKL data

Original IUCr paper

Formula: - C33 H79 Au4 K4 N6 Ni2 O25 S6 -
Comments: Hashimoto, Yuji; Taguchi, Mai; Yoshinari, Nobuto; Konno, Takumi Tetrapotassium [μ~2~-<i>N</i>-carboxylato-<small>D</small>-penicillaminato(3‒)-5:6κ^2^<i>S</i>:<i>S</i>][μ~2~-<small>D</small>-penicillaminato(1‒)-2:3κ^2^<i>S</i>:<i>S</i>]tetrakis[μ~2~-<small>D</small>-penicillaminato(2‒)]-1:2κ^3^<i>N</i>,<i>S</i>:<i>S</i>;1:6κ^3^<i>N</i>,<i>S</i>:<i>S</i>;3:4κ^3^<i>S</i>:<i>N</i>,<i>S</i>;4:5κ^3^<i>N</i>,<i>S</i>:<i>S</i>-2,3,5,6-tetragold(I)-1,4-dinickel(II) ethanol monosolvate decahydrate Acta Crystallographica Section C 66(6) (2010) m160-m162
Space group: P 1 21 1
Cell volume: 3289.5
Cell parameters: 9.9638; 22.644; 14.723; 90; 97.998; 90;  

COD ID: 2017681
CIF file

HKL data

Original IUCr paper

Formula: - C4 H7 N O6 -
Comments: Tumanov, Nikolay A.; Boldyreva, Elena V.; Shikina, Natalia E. Two new structures in the glycine‒oxalic acid system Acta Crystallographica Section C 66(6) (2010) o279-o283
Space group: P 1 21/c 1
Cell volume: 1300.67
Cell parameters: 11.8719; 6.1493; 20.8247; 90; 121.18; 90;  

COD ID: 2017682
CIF file

HKL data

Original IUCr paper

Formula: - C8 H20 N2 O10 -
Comments: Tumanov, Nikolay A.; Boldyreva, Elena V.; Shikina, Natalia E. Two new structures in the glycine‒oxalic acid system Acta Crystallographica Section C 66(6) (2010) o279-o283
Space group: P 1 21/c 1
Cell volume: 702.73
Cell parameters: 5.0068; 11.3293; 12.893; 90; 106.077; 90;  

COD ID: 2017683
CIF file

HKL data

Original IUCr paper

Formula: - C6 H3 B3 F9 K3 -
Comments: Franz, Daniel; Wagner, Matthias; Lerner, Hans-Wolfram; Bolte, Michael The twinned crystal structure of tripotassium benzene-1,3,5-tris(trifluoroborate) Acta Crystallographica Section C 66(6) (2010) m152-m156
Space group: P -1
Cell volume: 640.7
Cell parameters: 7.4025; 8.9349; 11.16; 68.66; 74.28; 71.14;  

COD ID: 2017684
CIF file

HKL data

Original IUCr paper

Formula: - C6 H14 N2 O -
Comments: Wicher, Barbara; Gdaniec, Maria Polymorphs of DABCO monohydrate as structural analogues of NaCl Acta Crystallographica Section C 66(6) (2010) o270-o273
Space group: P 31
Cell volume: 1610.78
Cell parameters: 11.03798; 11.03798; 15.266; 90; 90; 120;  

COD ID: 2017685
CIF file

HKL data

Original IUCr paper

Formula: - C17 H19 F N2 O2 -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Two polymorphs of safinamide, a selective and reversible inhibitor of monoamine oxidase B Acta Crystallographica Section C 66(6) (2010) o317-o320
Space group: P 21 21 21
Cell volume: 1631.4
Cell parameters: 5.1127; 17.8516; 17.8746; 90; 90; 90;  

COD ID: 2017686
CIF file

HKL data

Original IUCr paper

Formula: - C17 H19 F N2 O2 -
Comments: Ravikumar, Krishnan; Sridhar, Balasubramanian Two polymorphs of safinamide, a selective and reversible inhibitor of monoamine oxidase B Acta Crystallographica Section C 66(6) (2010) o317-o320
Space group: P 21 21 21
Cell volume: 1572
Cell parameters: 6.6297; 8.1015; 29.268; 90; 90; 90;  

COD ID: 2017687
CIF file

HKL data

Original IUCr paper

Formula: - C6 H4 Cr Cs3 O14 -
Comments: Martin, Lee; Christian, Anthony; Akutsu, Hiroki Tricaesium tris(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)chromate(III) dihydrate Acta Crystallographica Section C 66(6) (2010) m157-m159
Space group: P -1
Cell volume: 809.14
Cell parameters: 8.2299; 10.2956; 10.9902; 63.662; 89.775; 77.221;  

COD ID: 2017688
CIF file

HKL data

Original IUCr paper

Formula: - C40 H34 N12 O9 Zn2 -
Comments: Duan, Li; Wu, Xiang-Wen; Ma, Jian-Ping; Dong, Yu-Bin Poly[[{μ~4~-3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]benzoato}zinc(II)] hemihydrate]: a novel two-dimensional framework formed by self-association of zinc(II) sulfate with 3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]benzoic acid Acta Crystallographica Section C 66(6) (2010) m149-m151
Space group: P b c a
Cell volume: 4041.9
Cell parameters: 13.875; 13.142; 22.166; 90; 90; 90;  

COD ID: 2017689
CIF file

HKL data

Original IUCr paper

Formula: - C22 H18 Cl2 Co N6 O -
Comments: Wu, Yan; Hou, Gui-Ge; Ma, Jian-Ping; Dong, Yu-Bin A novel 18-membered metallocycle in {2,5-bis[3-(1<i>H</i>-1,3-imidazol-1-ylmethyl)phenyl]-1,3,4-oxadiazole}dichloridocobalt(II) Acta Crystallographica Section C 66(6) (2010) m163-m165
Space group: P -1
Cell volume: 1115.9
Cell parameters: 7.313; 11.056; 14.572; 74.376; 79.57; 87.592;  

COD ID: 2017690
CIF file

HKL data

Original IUCr paper

Formula: - H5 O6.5 Se V -
Comments: Harrison, William T. A. [VO(SeO~3~)(H~2~O)~2~]·0.5H~2~O Acta Crystallographica Section C 66(6) (2010) i61-i63
Space group: C 1 2/c 1
Cell volume: 1116.48
Cell parameters: 18.7819; 6.2881; 10.5581; 90; 116.443; 90;  

COD ID: 2017691
CIF file

HKL data

Original IUCr paper

Formula: - C11 H21 N2 O5 P -
Comments: Arfaoui, Youssef; Kouass, Salah; Salah, Nesrine; Ben Akacha, Azaiez; Guesmi, Abderrahmen Ethyl 3-[1-(5,5-dimethyl-2-oxo-1,3,2-dioxaphosphorin-2-yl)propan-2-ylidene]carbazate: a combined X-ray and density functional theory (DFT) study Acta Crystallographica Section C 66(7) (2010) o353-o355
Space group: P 1 21 1
Cell volume: 738.7
Cell parameters: 7.235; 10.823; 9.545; 90; 98.78; 90;  

COD ID: 2017692
CIF file

HKL data

Original IUCr paper

Formula: - C14 H17 Cl2 N3 O -
Comments: Heilmann-Brohl, Julia; Wagner, Matthias; Lerner, Hans-Wolfram; Bolte, Michael Structural comparison of three <i>N</i>-(4-halogenophenyl)-<i>N</i>'-[1-(2-pyridyl)ethylidene]hydrazine hydrochlorides Acta Crystallographica Section C 66(7) (2010) o364-o368
Space group: P 1 21/c 1
Cell volume: 1486.18
Cell parameters: 7.6715; 16.0963; 12.0406; 90; 91.666; 90;  

COD ID: 2017693
CIF file

HKL data

Original IUCr paper

Formula: - C13 H13 Cl F N3 -
Comments: Heilmann-Brohl, Julia; Wagner, Matthias; Lerner, Hans-Wolfram; Bolte, Michael Structural comparison of three <i>N</i>-(4-halogenophenyl)-<i>N</i>'-[1-(2-pyridyl)ethylidene]hydrazine hydrochlorides Acta Crystallographica Section C 66(7) (2010) o364-o368
Space group: P 1 21/n 1
Cell volume: 1250.9
Cell parameters: 6.8522; 11.5134; 15.856; 90; 90.048; 90;  

COD ID: 2017694
CIF file

HKL data

Original IUCr paper

Formula: - C15 H21 Cl F N3 O2 -
Comments: Heilmann-Brohl, Julia; Wagner, Matthias; Lerner, Hans-Wolfram; Bolte, Michael Structural comparison of three <i>N</i>-(4-halogenophenyl)-<i>N</i>'-[1-(2-pyridyl)ethylidene]hydrazine hydrochlorides Acta Crystallographica Section C 66(7) (2010) o364-o368
Space group: P -1
Cell volume: 1699.5
Cell parameters: 7.0088; 11.7258; 21.843; 96.321; 92.066; 107.247;  

COD ID: 2017695
CIF file

HKL data

Original IUCr paper

Formula: - C24 H26 Cl Cr N3 O2 Rh -
Comments: Vibenholt, Johan; Magnussen, Magnus; Anthon, Christian; Bendix, Jesper Synthesis and molecular structure of Cr(salen)(μ-N)RhCl(COD): the first example of a heterobimetallic nitride-bridged complex containing chromium Acta Crystallographica Section C 66(7) (2010) m177-m179
Space group: P 1 21/c 1
Cell volume: 2306
Cell parameters: 12.614; 15.1085; 12.6704; 90; 107.259; 90;  

COD ID: 2017696
CIF file

HKL data

Original IUCr paper

Formula: - C24 H16 N2 O2 -
Comments: Schindler, Diana; Felsmann, Marika; Weber, Edwin Influence of 1,4-dioxane solvent inclusion on the crystal structure of 5,5'-diphenyl-2,2'-(<i>p</i>-phenylene)di-1,3-oxazole (POPOP) Acta Crystallographica Section C 66(7) (2010) o361-o363
Space group: P 1 21/c 1
Cell volume: 920.3
Cell parameters: 9.1393; 5.2461; 19.204; 90; 91.807; 90;  

COD ID: 2017697
CIF file

HKL data

Original IUCr paper

Formula: - C32 H32 N2 O6 -
Comments: Schindler, Diana; Felsmann, Marika; Weber, Edwin Influence of 1,4-dioxane solvent inclusion on the crystal structure of 5,5'-diphenyl-2,2'-(<i>p</i>-phenylene)di-1,3-oxazole (POPOP) Acta Crystallographica Section C 66(7) (2010) o361-o363
Space group: P 1 21/n 1
Cell volume: 1326.24
Cell parameters: 12.2424; 5.9115; 18.5046; 90; 97.977; 90;  

COD ID: 2017698
CIF file

Original IUCr paper

Formula: - C12 H13 N5 O4 -
Comments: Thanigaimani, Kaliyaperumal; Devi, Periasamy; Muthiah, Packianathan Thomas; Lynch, Daniel E.; Butcher, Ray J. Charge-assisted hydrogen-bonded supramolecular networks in acetoguanaminium hydrogen phthalate, acetoguanaminium hydrogen maleate and acetoguanaminium 3-hydroxypicolinate monohydrate Acta Crystallographica Section C 66(7) (2010) o324-o328
Space group: P 1 21/c 1
Cell volume: 1286.53
Cell parameters: 7.0743; 23.4468; 8.1134; 90; 107.063; 90;  

COD ID: 2017699
CIF file

HKL data

Original IUCr paper

Formula: - C8 H11 N5 O4 -
Comments: Thanigaimani, Kaliyaperumal; Devi, Periasamy; Muthiah, Packianathan Thomas; Lynch, Daniel E.; Butcher, Ray J. Charge-assisted hydrogen-bonded supramolecular networks in acetoguanaminium hydrogen phthalate, acetoguanaminium hydrogen maleate and acetoguanaminium 3-hydroxypicolinate monohydrate Acta Crystallographica Section C 66(7) (2010) o324-o328
Space group: P -1
Cell volume: 536.58
Cell parameters: 7.1921; 8.2359; 9.4775; 98.287; 104.656; 91.032;  

COD ID: 2017700
CIF file

HKL data

Original IUCr paper

Formula: - C10 H14 N6 O4 -
Comments: Thanigaimani, Kaliyaperumal; Devi, Periasamy; Muthiah, Packianathan Thomas; Lynch, Daniel E.; Butcher, Ray J. Charge-assisted hydrogen-bonded supramolecular networks in acetoguanaminium hydrogen phthalate, acetoguanaminium hydrogen maleate and acetoguanaminium 3-hydroxypicolinate monohydrate Acta Crystallographica Section C 66(7) (2010) o324-o328
Space group: P 1 21/c 1
Cell volume: 1299.9
Cell parameters: 7.0397; 24.68; 7.5047; 90; 94.462; 90;  

COD ID: 2017701
CIF file

HKL data

Original IUCr paper

Formula: - H8 N2 O8 Te2 W -
Comments: Grzechnik, A.; Halasyamani, P. S.; Kim, J.-H.; Friese, K. (NH~4~)~2~WTe~2~O~8~ at 5.09GPa: a single-crystal study using synchrotron radiation Acta Crystallographica Section C 66(7) (2010) i79-i81
Space group: P 1 21 1
Cell volume: 407.6
Cell parameters: 6.443; 6.883; 9.301; 90; 98.8; 90;  

COD ID: 2017702
CIF file

HKL data

Original IUCr paper

Formula: - C16 H17 N3 O6 -
Comments: Smith, Graham; Wermuth, Urs D.; Young, David J. Phenyl-ring rotational disorder in the two-dimensional hydrogen-bonded structure of the 1:1 proton-transfer salt of the diazo-dye precursor 4-(phenyldiazenyl)aniline (aniline yellow) with <small>L</small>-tartaric acid Acta Crystallographica Section C 66(7) (2010) o345-o348
Space group: P 1
Cell volume: 792.33
Cell parameters: 6.171; 7.4134; 18.2438; 91.754; 91.308; 108.135;  

COD ID: 2017703
CIF file

HKL data

Original IUCr paper

Formula: - C50 H72 Cd N14 O4 S2 -
Comments: Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V. Cadmium(II) thio- and selenocyanate complexes of 3,3'-bis(1,2,4-triazol-4-yl)-1,1'-biadamantane, a ligand designed with an `extended nanodiamond' aliphatic platform Acta Crystallographica Section C 66(7) (2010) m180-m183
Space group: P 1 21/c 1
Cell volume: 2534.3
Cell parameters: 6.8689; 20.3896; 18.333; 90; 99.242; 90;  

COD ID: 2017704
CIF file

HKL data

Original IUCr paper

Formula: - C50 H72 Cd N14 O4 Se2 -
Comments: Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V. Cadmium(II) thio- and selenocyanate complexes of 3,3'-bis(1,2,4-triazol-4-yl)-1,1'-biadamantane, a ligand designed with an `extended nanodiamond' aliphatic platform Acta Crystallographica Section C 66(7) (2010) m180-m183
Space group: P 1 21/c 1
Cell volume: 2566.2
Cell parameters: 6.9147; 20.4704; 18.419; 90; 100.168; 90;  

COD ID: 2017705
CIF file

HKL data

Original IUCr paper

Formula: - C18 H12 Br3 Cl6 N Sb -
Comments: Quiroz-Guzman, Mauricio; Brown, Seth N. Tris(4-bromophenyl)aminium hexachloridoantimonate (`Magic Blue'): a strong oxidant with low inner-sphere reorganization Acta Crystallographica Section C 66(7) (2010) m171-m173
Space group: P b c n
Cell volume: 4801
Cell parameters: 17.4052; 16.4768; 16.7408; 90; 90; 90;  

COD ID: 2017706
CIF file

HKL data

Original IUCr paper

Formula: - C18 H12 Br3 N -
Comments: Quiroz-Guzman, Mauricio; Brown, Seth N. Tris(4-bromophenyl)aminium hexachloridoantimonate (`Magic Blue'): a strong oxidant with low inner-sphere reorganization Acta Crystallographica Section C 66(7) (2010) m171-m173
Space group: P 1 21/c 1
Cell volume: 1633.5
Cell parameters: 9.397; 16.0352; 11.3688; 90; 107.534; 90;  

COD ID: 2017707
CIF file

HKL data

Original IUCr paper

Formula: - C13 H12 N4 O7 -
Comments: Meng, Gao-Xiang; Yang, He-Lin; Cheng, Cui-Xia; Huang, Xin-Tang Two-dimensional networks in 2-methylanilinium picrate and 2,5-dichloroanilinium picrate Acta Crystallographica Section C 66(7) (2010) o337-o340
Space group: P 1 21/c 1
Cell volume: 1450.51
Cell parameters: 11.6501; 16.4813; 7.5754; 90; 94.269; 90;  

COD ID: 2017708
CIF file

HKL data

Original IUCr paper

Formula: - C12 H8 Cl2 N4 O7 -
Comments: Meng, Gao-Xiang; Yang, He-Lin; Cheng, Cui-Xia; Huang, Xin-Tang Two-dimensional networks in 2-methylanilinium picrate and 2,5-dichloroanilinium picrate Acta Crystallographica Section C 66(7) (2010) o337-o340
Space group: C 1 c 1
Cell volume: 1542.1
Cell parameters: 4.3288; 23.372; 15.292; 90; 94.606; 90;  

COD ID: 2017709
CIF file

HKL data

Original IUCr paper

Formula: - C14 H19 Cl2 N O4 -
Comments: Smith, Graham; Wermuth, Urs D. Low-dimensional hydrogen-bonded structures in the 1:1 and 1:2 proton-transfer compounds of 4,5-dichlorophthalic acid with the aliphatic Lewis bases triethylamine, diethylamine, <i>n</i>-butylamine and piperidine Acta Crystallographica Section C 66(7) (2010) o374-o380
Space group: P 1 21/c 1
Cell volume: 1582.3
Cell parameters: 7.3206; 11.2201; 19.4813; 90; 98.576; 90;  

COD ID: 2017710
CIF file

HKL data

Original IUCr paper

Formula: - C12 H15 Cl2 N O4 -
Comments: Smith, Graham; Wermuth, Urs D. Low-dimensional hydrogen-bonded structures in the 1:1 and 1:2 proton-transfer compounds of 4,5-dichlorophthalic acid with the aliphatic Lewis bases triethylamine, diethylamine, <i>n</i>-butylamine and piperidine Acta Crystallographica Section C 66(7) (2010) o374-o380
Space group: P 1 21/c 1
Cell volume: 1465.2
Cell parameters: 8.9588; 9.9042; 17.062; 90; 104.58; 90;  

COD ID: 2017711
CIF file

HKL data

Original IUCr paper

Formula: - C16 H28 Cl2 N2 O5 -
Comments: Smith, Graham; Wermuth, Urs D. Low-dimensional hydrogen-bonded structures in the 1:1 and 1:2 proton-transfer compounds of 4,5-dichlorophthalic acid with the aliphatic Lewis bases triethylamine, diethylamine, <i>n</i>-butylamine and piperidine Acta Crystallographica Section C 66(7) (2010) o374-o380
Space group: P -1
Cell volume: 1058.62
Cell parameters: 8.1362; 9.3043; 15.406; 78.678; 85.846; 67.777;  

COD ID: 2017712
CIF file

HKL data

Original IUCr paper

Formula: - C18 H28 Cl2 N2 O5 -
Comments: Smith, Graham; Wermuth, Urs D. Low-dimensional hydrogen-bonded structures in the 1:1 and 1:2 proton-transfer compounds of 4,5-dichlorophthalic acid with the aliphatic Lewis bases triethylamine, diethylamine, <i>n</i>-butylamine and piperidine Acta Crystallographica Section C 66(7) (2010) o374-o380
Space group: P 1 21/c 1
Cell volume: 2111.8
Cell parameters: 13.8481; 10.5937; 14.6129; 90; 99.903; 90;  

COD ID: 2017713
CIF file

HKL data

Original IUCr paper

Formula: - C49 H62 Cl6 O4 -
Comments: Gruber, Tobias; Eissmann, Frank; Seichter, Wilhelm; Weber, Edwin 25-Allyloxy-5,11,17,23-tetra-<i>tert</i>-butyl-26,27,28-trihydroxycalix[4]arene chloroform disolvate Acta Crystallographica Section C 66(7) (2010) o334-o336
Space group: C 1 2/c 1
Cell volume: 9806.5
Cell parameters: 28.8774; 16.8275; 23.3186; 90; 120.068; 90;  

COD ID: 2017714
CIF file

HKL data

Original IUCr paper

Formula: - C24 H21 F2 N O3 -
Comments: Brüning, Jürgen; Alig, Edith; Schmidt, Martin U. Ezetimibe anhydrate, determined from laboratory powder diffraction data Acta Crystallographica Section C 66(7) (2010) o341-o344
Space group: P 21 21 21
Cell volume: 2019.69
Cell parameters: 5.94606; 15.8898; 21.3765; 90; 90; 90;  

COD ID: 2017715
CIF file

HKL data

Original IUCr paper

Formula: - C10 H21.188 N3 O5.094 -
Comments: Görbitz, Carl Henrik; Backe, Paul Hoff <small>L</small>-Isoleucyl-<small>L</small>-asparagine 1.094-hydrate: a hybrid hydrogen-bonding pattern Acta Crystallographica Section C 66(7) (2010) o349-o352
Space group: P 21 21 21
Cell volume: 2734.8
Cell parameters: 4.7855; 18.2887; 31.247; 90; 90; 90;  

COD ID: 2017716
CIF file

HKL data

Original IUCr paper

Formula: - C7 H14 O6 -
Comments: Allscher, Thorsten; Klüfers, Peter Methyl β-<small>D</small>-fructopyranoside Acta Crystallographica Section C 66(7) (2010) o321-o323
Space group: C 1 2 1
Cell volume: 866.92
Cell parameters: 14.999; 5.4114; 10.8287; 90; 99.477; 90;  

COD ID: 2017717
CIF file

HKL data

Original IUCr paper

Formula: - Cs6 Nb4 Se22 -
Comments: Krizan, Jason W.; Pulido, Sergio H.; Wehrhan, Sarah E.; Chan, Benny C. Cs~6~Nb~4~Se~22~ and K~12~Nb~6~Se~35.3~: two new compounds containing the <i>M</i>~4~<i>Q</i>~22~ building block Acta Crystallographica Section C 66(7) (2010) i75-i78
Space group: P 1 21/c 1
Cell volume: 2113.72
Cell parameters: 12.5887; 8.5127; 20.3151; 90; 103.853; 90;  

COD ID: 2017718
CIF file

HKL data

Original IUCr paper

Formula: - K12 Nb6 Se35.3 -
Comments: Krizan, Jason W.; Pulido, Sergio H.; Wehrhan, Sarah E.; Chan, Benny C. Cs~6~Nb~4~Se~22~ and K~12~Nb~6~Se~35.3~: two new compounds containing the <i>M</i>~4~<i>Q</i>~22~ building block Acta Crystallographica Section C 66(7) (2010) i75-i78
Space group: P b c n
Cell volume: 6180
Cell parameters: 8.329; 13.2559; 55.974; 90; 90; 90;  

COD ID: 2017719
CIF file

HKL data

Original IUCr paper

Formula: - As3 K2 O12 Sc Sn -
Comments: Harrison, William T. A. K~2~ScSn(AsO~4~)~3~: an arsenate-containing langbeinite Acta Crystallographica Section C 66(7) (2010) i82-i84
Space group: P 21 3
Cell volume: 1122.5
Cell parameters: 10.3927; 10.3927; 10.3927; 90; 90; 90;  

COD ID: 2017720
CIF file

HKL data

Original IUCr paper

Formula: - C17 H9 Br2 Cl N2 O -
Comments: Abboud, Mohamed; Kadimi, Amal; Mamane, Victor; Aubert, Emmanuel Conformational disorder in 4-(5,5'-dibromo-2'-chloro-4,4'-bipyridyl-2-yl)benzaldehyde: role of π‒π and halogen interactions Acta Crystallographica Section C 66(7) (2010) o381-o384
Space group: P -1
Cell volume: 787.52
Cell parameters: 7.5759; 8.4629; 13.1534; 103.082; 94.473; 104.401;  

COD ID: 2017721
CIF file

HKL data

Original IUCr paper

Formula: - C8 H12 N3 O3.5 S -
Comments: Bhattacharya, Abir; Roy, Bhairab Nath; Singh, Girij Pal; Srivastava, Dhananjai; Mukherjee, Alok K. Lamivudine hemihydrate Acta Crystallographica Section C 66(7) (2010) o329-o333
Space group: P 1 21 1
Cell volume: 2078.06
Cell parameters: 11.5729; 11.2385; 16.0232; 90; 94.329; 90;  

COD ID: 2017722
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 Ag2 N6 O8 -
Comments: Sun, Di; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun Diamminesilver(I) bis(2-amino-5-nitrobenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)silver(I): a two-dimensional supramolecular sheet with a short intersheet distance containing a rare four-coordinate planar silver(I) centre Acta Crystallographica Section C 66(7) (2010) m174-m176
Space group: P -1
Cell volume: 456.86
Cell parameters: 7.1361; 7.407; 9.9686; 87.064; 79.17; 62.077;  

COD ID: 2017723
CIF file

HKL data

Original IUCr paper

Formula: - C9 H17 Cl N2 Ti -
Comments: Chapin, Brette M.; Hughs, Lauren D.; Golen, James A.; Rheingold, Arnold L.; Johnson, Adam R. Chlorido(η^5^-cyclopentadienyl)bis(dimethylamido)titanium, [TiCl(η^5^-C~5~H~5~)(NMe~2~)~2~] Acta Crystallographica Section C 66(7) (2010) m191-m193
Space group: P 1 21/n 1
Cell volume: 1163.37
Cell parameters: 9.3621; 11.0618; 11.5907; 90; 104.259; 90;  

COD ID: 2017724
CIF file

HKL data

Original IUCr paper

Formula: - C10 H15 N3 O2 -
Comments: Payne, Thomas J.; Thurman, Chad R.; Yu, Hao; Sun, Qian; Mohanty, Dillip K.; Squattrito, Philip J.; Giolando, Mark-Robin; Brue, Christopher R.; Kirschbaum, Kristin <i>N</i>,<i>N</i>'-Diethyl-4-nitrobenzene-1,3-diamine, 2,6-bis(ethylamino)-3-nitrobenzonitrile and bis(4-ethylamino-3-nitrophenyl) sulfone Acta Crystallographica Section C 66(7) (2010) o369-o373
Space group: P 1 21/c 1
Cell volume: 2172.2
Cell parameters: 7.8148; 20.9889; 13.2464; 90; 91.21; 90;  

COD ID: 2017725
CIF file

HKL data

Original IUCr paper

Formula: - C11 H14 N4 O2 -
Comments: Payne, Thomas J.; Thurman, Chad R.; Yu, Hao; Sun, Qian; Mohanty, Dillip K.; Squattrito, Philip J.; Giolando, Mark-Robin; Brue, Christopher R.; Kirschbaum, Kristin <i>N</i>,<i>N</i>'-Diethyl-4-nitrobenzene-1,3-diamine, 2,6-bis(ethylamino)-3-nitrobenzonitrile and bis(4-ethylamino-3-nitrophenyl) sulfone Acta Crystallographica Section C 66(7) (2010) o369-o373
Space group: P 1 21/c 1
Cell volume: 1133.9
Cell parameters: 10.988; 4.865; 21.22; 90; 91.62; 90;  

COD ID: 2017726
CIF file

HKL data

Original IUCr paper

Formula: - C16 H18 N4 O6 S -
Comments: Payne, Thomas J.; Thurman, Chad R.; Yu, Hao; Sun, Qian; Mohanty, Dillip K.; Squattrito, Philip J.; Giolando, Mark-Robin; Brue, Christopher R.; Kirschbaum, Kristin <i>N</i>,<i>N</i>'-Diethyl-4-nitrobenzene-1,3-diamine, 2,6-bis(ethylamino)-3-nitrobenzonitrile and bis(4-ethylamino-3-nitrophenyl) sulfone Acta Crystallographica Section C 66(7) (2010) o369-o373
Space group: P 1 21/c 1
Cell volume: 1799.9
Cell parameters: 15.514; 8.573; 15.012; 90; 115.647; 90;  

COD ID: 2017727
CIF file

HKL data

Original IUCr paper

Formula: - Cs3 In3 O16 P4 -
Comments: Zatovsky, Igor V.; Baumer, Vyacheslav N.; Strutynska, Nataliya Yu.; Slobodyanik, Nikolay S.; Shishkin, Oleg V. A novel In~3~O~16~ fragment in Cs~3~In~3~(PO~4~)~4~ Acta Crystallographica Section C 66(7) (2010) i71-i74
Space group: C 1 2/c 1
Cell volume: 1642.63
Cell parameters: 16.437; 10.0498; 9.9473; 90; 91.485; 90;  

COD ID: 2017728
CIF file

HKL data

Original IUCr paper

Formula: - C10 H16 Ca Cu O10 -
Comments: Guo, Ming-Lin; Wang, Feng-Qin Poly[diaquabis(μ~3~-2,2-dimethylpropanedioato)calcium(II)copper(II)] Acta Crystallographica Section C 66(7) (2010) m184-m187
Space group: P -1
Cell volume: 748.8
Cell parameters: 9.0113; 9.6052; 9.6248; 79.95; 72.14; 71.4;  

COD ID: 2017729
CIF file

HKL data

Original IUCr paper

Formula: - C15 H36 Cl4 N2 O6 Zn -
Comments: Zhao, Min Min; Qu, Zhi Rong Propane-1,3-diaminium tetrachloridozincate(II) 18-crown-6 clathrate Acta Crystallographica Section C 66(7) (2010) m188-m190
Space group: P 21 21 21
Cell volume: 2505.1
Cell parameters: 9.134; 9.862; 27.81; 90; 90; 90;  

COD ID: 2017730
CIF file

HKL data

Original IUCr paper

Formula: - C8 H10 O4 Sr -
Comments: Robertson, Karen A.; Harrison, William T. A. Poly[(μ~6~-<i>rac</i>-<i>cis</i>-cyclohexane-1,2-dicarboxylato)strontium] Acta Crystallographica Section C 66(7) (2010) m194-m196
Space group: P 1 21/c 1
Cell volume: 896.26
Cell parameters: 13.3937; 7.0389; 9.971; 90; 107.555; 90;  

COD ID: 2017731
CIF file

HKL data

Original IUCr paper

Formula: - C10 H6 F4 N2 O2 -
Comments: Czapik, Agnieszka; Gdaniec, Maria Cocrystals of 2,3,5,6-tetrafluorobenzene-1,4-diol with diaza aromatic compounds Acta Crystallographica Section C 66(7) (2010) o356-o360
Space group: P -1
Cell volume: 259.34
Cell parameters: 3.6671; 7.585; 9.582; 88.14; 85.67; 77.41;  

COD ID: 2017732
CIF file

HKL data

Original IUCr paper

Formula: - C14 H8 F4 N2 O2 -
Comments: Czapik, Agnieszka; Gdaniec, Maria Cocrystals of 2,3,5,6-tetrafluorobenzene-1,4-diol with diaza aromatic compounds Acta Crystallographica Section C 66(7) (2010) o356-o360
Space group: P 21 21 21
Cell volume: 1263.2
Cell parameters: 7.2094; 7.429; 23.585; 90; 90; 90;  

COD ID: 2017733
CIF file

HKL data

Original IUCr paper

Formula: - C30 H18 F4 N4 O2 -
Comments: Czapik, Agnieszka; Gdaniec, Maria Cocrystals of 2,3,5,6-tetrafluorobenzene-1,4-diol with diaza aromatic compounds Acta Crystallographica Section C 66(7) (2010) o356-o360
Space group: P 1 21/n 1
Cell volume: 1224.01
Cell parameters: 9.1482; 11.0393; 12.4185; 90; 102.585; 90;  

COD ID: 2017734
CIF file

HKL data

Original IUCr paper

Formula: - C46 H36 Cu4 N20 O22 S4 -
Comments: Li, Xiao-Wen; Li, Yan-Tuan; Wu, Zhi-Yong; Jiang, Fu-Bin [μ~3~-<i>cis</i>-<i>N</i>-(2-Aminoethyl)-<i>N</i>'-(2-carboxylatophenyl)oxamidato(3{-})]bis(2,2'-diamino-4,4'-bi-1,3-thiazole)tetracopper(II) bis(2,4,6-trinitrophenolate) Acta Crystallographica Section C 66(8) (2010) m218-m221
Space group: P -1
Cell volume: 1404.91
Cell parameters: 10.5528; 10.9391; 13.1938; 102.367; 98.134; 105.059;  

COD ID: 2017735
CIF file

HKL data

Original IUCr paper

Formula: - C50 H42 F8 N4 -
Comments: Marushima, Yuta; Uchiumi, Yuri; Ogu, Kenichi; Hori, Akiko Intermolecular π-stacking and F···F interactions of fluorine-substituted <i>meso</i>-alkynylporphyrin Acta Crystallographica Section C 66(8) (2010) o406-o409
Space group: P 1 21/n 1
Cell volume: 1983.3
Cell parameters: 4.7936; 23.483; 17.628; 90; 91.824; 90;  

COD ID: 2017736
CIF file

HKL data

Original IUCr paper

Formula: - C50 H50 N4 -
Comments: Marushima, Yuta; Uchiumi, Yuri; Ogu, Kenichi; Hori, Akiko Intermolecular π-stacking and F···F interactions of fluorine-substituted <i>meso</i>-alkynylporphyrin Acta Crystallographica Section C 66(8) (2010) o406-o409
Space group: C 1 2/c 1
Cell volume: 3832.8
Cell parameters: 33.613; 5.2845; 23.152; 90; 111.252; 90;  

COD ID: 2017737
CIF file

HKL data

Original IUCr paper

Formula: - C26 H45 B N6 Zn -
Comments: Kumar, Mukesh; Papish, Elizabeth T.; Zeller, Matthias Ethyl[tris(3-<i>tert</i>-butyl-5-methylpyrazol-1-yl)hydridoborato]zinc(II) Acta Crystallographica Section C 66(8) (2010) m197-m200
Space group: P 1 21/c 1
Cell volume: 5523
Cell parameters: 30.803; 9.796; 19.157; 90; 107.174; 90;  

COD ID: 2017738
CIF file

HKL data

Original IUCr paper

Formula: - C26 H45 B N6 Zn -
Comments: Kumar, Mukesh; Papish, Elizabeth T.; Zeller, Matthias Ethyl[tris(3-<i>tert</i>-butyl-5-methylpyrazol-1-yl)hydridoborato]zinc(II) Acta Crystallographica Section C 66(8) (2010) m197-m200
Space group: P 1 21/c 1
Cell volume: 5535.2
Cell parameters: 30.83; 9.8047; 19.17; 90; 107.211; 90;  

COD ID: 2017739
CIF file

HKL data

Original IUCr paper

Formula: - C26 H45 B N6 Zn -
Comments: Kumar, Mukesh; Papish, Elizabeth T.; Zeller, Matthias Ethyl[tris(3-<i>tert</i>-butyl-5-methylpyrazol-1-yl)hydridoborato]zinc(II) Acta Crystallographica Section C 66(8) (2010) m197-m200
Space group: P 1 21/c 1
Cell volume: 5535.2
Cell parameters: 30.83; 9.8047; 19.17; 90; 107.211; 90;  

COD ID: 2017740
CIF file

HKL data

Original IUCr paper

Formula: - C6 H10 O5 -
Comments: Lutz, Martin; van Krieken, Jan (<i>S</i>,<i>S</i>)-Lactoyllactic acid and (<i>S</i>,<i>S</i>,<i>S</i>)-lactoyllactoyllactic acid Acta Crystallographica Section C 66(8) (2010) o401-o405
Space group: P 21 21 21
Cell volume: 1565.7
Cell parameters: 7.94437; 11.71472; 16.82348; 90; 90; 90;  

COD ID: 2017741
CIF file

HKL data

Original IUCr paper

Formula: - C9 H14 O7 -
Comments: Lutz, Martin; van Krieken, Jan (<i>S</i>,<i>S</i>)-Lactoyllactic acid and (<i>S</i>,<i>S</i>,<i>S</i>)-lactoyllactoyllactic acid Acta Crystallographica Section C 66(8) (2010) o401-o405
Space group: C 1 2 1
Cell volume: 1134.71
Cell parameters: 17.3594; 5.62712; 13.9888; 90; 123.861; 90;  

COD ID: 2017742
CIF file

HKL data

Original IUCr paper

Formula: - C4 H14 N2 O4 -
Comments: Wiklund, Tove; McKenzie, Christine J.; Lennartson, Anders Graphene-like nets of hydrogen-bonded water molecules in the dihydrate of 2-[(2-ammonioethyl)amino]acetate and the structure of its anhydrous hydroiodide salt Acta Crystallographica Section C 66(8) (2010) o410-o413
Space group: P 1 21/n 1
Cell volume: 776.17
Cell parameters: 4.7106; 22.8634; 7.2804; 90; 98.154; 90;  

COD ID: 2017743
CIF file

HKL data

Original IUCr paper

Formula: - C4 H11 I N2 O2 -
Comments: Wiklund, Tove; McKenzie, Christine J.; Lennartson, Anders Graphene-like nets of hydrogen-bonded water molecules in the dihydrate of 2-[(2-ammonioethyl)amino]acetate and the structure of its anhydrous hydroiodide salt Acta Crystallographica Section C 66(8) (2010) o410-o413
Space group: P 1 21/n 1
Cell volume: 818.32
Cell parameters: 5.7129; 12.4269; 11.656; 90; 98.542; 90;  

COD ID: 2017744
CIF file

HKL data

Original IUCr paper

Formula: - C12 H18 O8 U -
Comments: Rusanova, Julia A.; Rusanov, Eduard B.; Domasevitch, Konstantin V. A new adamantanecarboxylate coordination polymer: poly[[(μ~3~-adamantane-1,3-dicarboxylato)aquadioxidouranium(VI)] monohydrate] Acta Crystallographica Section C 66(8) (2010) m207-m210
Space group: C 1 2/c 1
Cell volume: 2982.5
Cell parameters: 24.254; 6.7855; 20.2586; 90; 116.549; 90;  

COD ID: 2017745
CIF file

HKL data

Original IUCr paper

Formula: - C16 H18 N4 O6 -
Comments: Thompson, Laura J.; Voguri, Raja S.; Cowell, Adam; Male, Louise; Tremayne, Maryjane The cocrystal nicotinamide‒succinic acid (2/1) Acta Crystallographica Section C 66(8) (2010) o421-o424
Space group: P -1
Cell volume: 818.01
Cell parameters: 5.0872; 11.5569; 14.2784; 77.433; 86.726; 89.418;  

COD ID: 2017746
CIF file

HKL data

Original IUCr paper

Formula: - C7 H8 N2 O4 S -
Comments: John, Jain; Balasubramanian, T. <i>Z</i> and <i>E</i> isomers of butenedioic acid with 2-amino-1,3-thiazole: 2-amino-1,3-thiazolium hydrogen maleate and 2-amino-1,3-thiazolium hydrogen fumarate Acta Crystallographica Section C 66(8) (2010) o436-o440
Space group: P 1 21/n 1
Cell volume: 909.3
Cell parameters: 6.3372; 22.4153; 6.8618; 90; 111.112; 90;  

COD ID: 2017747
CIF file

HKL data

Original IUCr paper

Formula: - C7 H8 N2 O4 S -
Comments: John, Jain; Balasubramanian, T. <i>Z</i> and <i>E</i> isomers of butenedioic acid with 2-amino-1,3-thiazole: 2-amino-1,3-thiazolium hydrogen maleate and 2-amino-1,3-thiazolium hydrogen fumarate Acta Crystallographica Section C 66(8) (2010) o436-o440
Space group: P b c a
Cell volume: 5569.3
Cell parameters: 20.7129; 7.1803; 37.4469; 90; 90; 90;  

COD ID: 2017748
CIF file

HKL data

Original IUCr paper

Formula: - C64 H112 Mn2 N4 Na2 O4 Si4 -
Comments: Blake, Alexander J.; Harris, Naomi A.; Kays, Deborah L.; Lewis, William; Moxey, Graeme J. Bis[μ~3~-1,8-bis(triisopropylsilylamido)naphthalene]bis(tetrahydrofuran)di-μ~3~-oxido-dimanganese(III)disodium Acta Crystallographica Section C 66(8) (2010) m204-m206
Space group: P b c n
Cell volume: 6938.1
Cell parameters: 25.209; 17.6946; 15.5541; 90; 90; 90;  

COD ID: 2017749
CIF file

HKL data

Original IUCr paper

Formula: - C38 H33 N O S -
Comments: Sakthivel, Chinniah; Jeyaraman, Ramasubbu Forced twin-chair conformation in 7-benzoyl- and 7-phenylacetyl-<i>r</i>-2,<i>c</i>-4,<i>t</i>-6,<i>t</i>-8-tetraphenyl-3-thia-7-azabicyclo[3.3.1]nonanes with 1,3-diaxial phenyl groups in the piperidine ring: single- and double-layered supramolecular sheets built from C—H···O and C—H···π(arene) hydrogen bonds Acta Crystallographica Section C 66(8) (2010) o396-o400
Space group: P 1 21/c 1
Cell volume: 2855.8
Cell parameters: 16.139; 10.145; 17.453; 90; 92.046; 90;  

COD ID: 2017750
CIF file

HKL data

Original IUCr paper

Formula: - C39 H35 N O S -
Comments: Sakthivel, Chinniah; Jeyaraman, Ramasubbu Forced twin-chair conformation in 7-benzoyl- and 7-phenylacetyl-<i>r</i>-2,<i>c</i>-4,<i>t</i>-6,<i>t</i>-8-tetraphenyl-3-thia-7-azabicyclo[3.3.1]nonanes with 1,3-diaxial phenyl groups in the piperidine ring: single- and double-layered supramolecular sheets built from C—H···O and C—H···π(arene) hydrogen bonds Acta Crystallographica Section C 66(8) (2010) o396-o400
Space group: P 1 21/c 1
Cell volume: 3074.2
Cell parameters: 16.8724; 9.4863; 19.2376; 90; 93.245; 90;  

COD ID: 2017751
CIF file

HKL data

Original IUCr paper

Formula: - C18 H34 B N O2 Si -
Comments: Gainsford, Graeme J.; Luxenburger, Andreas; Woolhouse, Anthony D. (1<i>R</i>,3<i>R</i>,4<i>S</i>)-1-Benzyl-3-(<i>tert</i>-butyldimethylsilyloxy)-4-(hydroxymethyl)pyrrolidine‒borane: novel B—H···H—O hydrogen bonding Acta Crystallographica Section C 66(8) (2010) o418-o420
Space group: P 21 21 21
Cell volume: 2073.2
Cell parameters: 7.8078; 11.2328; 23.639; 90; 90; 90;  

COD ID: 2017752
CIF file

HKL data

Original IUCr paper

Formula: - C40 H32 Dy2 N16 O26 -
Comments: Lipstman, Sophia; Goldberg, Israel Coordination and hydrogen-bonding assemblies in hybrid reaction products between 5,10,15,20-tetra-4-pyridylporphyrin and dysprosium trinitrate hexahydrate Acta Crystallographica Section C 66(8) (2010) m222-m226
Space group: P -1
Cell volume: 1492.45
Cell parameters: 7.7897; 12.2577; 17.2316; 70.1447; 89.341; 75.3827;  

COD ID: 2017753
CIF file

HKL data

Original IUCr paper

Formula: - C44 H56 Dy N15 O30 -
Comments: Lipstman, Sophia; Goldberg, Israel Coordination and hydrogen-bonding assemblies in hybrid reaction products between 5,10,15,20-tetra-4-pyridylporphyrin and dysprosium trinitrate hexahydrate Acta Crystallographica Section C 66(8) (2010) m222-m226
Space group: P -1
Cell volume: 2811.52
Cell parameters: 12.8961; 12.9222; 18.5978; 71.6843; 80.9684; 73.3707;  

COD ID: 2017754
CIF file

HKL data

Original IUCr paper

Formula: - C22 H18 N4 O8 -
Comments: Moreno-Fuquen, Rodolfo; Theodoro, Jahyr; Ellena, Javier; Montaño-A., Angela Marcela; Atencio, Reynaldo 3-Nitrophenol‒4,4'-bipyridyl <i>N</i>,<i>N</i>'-dioxide (2/1): a DFT study and CSD analysis of DPNO molecular complexes Acta Crystallographica Section C 66(8) (2010) o425-o428
Space group: P 1 21/c 1
Cell volume: 1104.2
Cell parameters: 10.5167; 5.9729; 18.2602; 90; 105.7; 90;  

COD ID: 2017755
CIF file

HKL data

Original IUCr paper

Formula: - C80 H74 Cl4 N6 O8 S24 -
Comments: Kaboub, Lakhemici; Fabre, Jean-Marc; Vendier, Laure; Legros, Jean-Pierre Donor‒acceptor complex of a new bis-TTF donor containing a pyridine diester spacer with TCNQ as the acceptor: a disappointing system Acta Crystallographica Section C 66(8) (2010) o429-o432
Space group: P -1
Cell volume: 2321.2
Cell parameters: 11.322; 12.9538; 17.659; 71.165; 84.364; 71.257;  

COD ID: 2017756
CIF file

HKL data

Original IUCr paper

Formula: - C32 H62 Cl4 N2 O7 Zn -
Comments: Zhao, Min Min; Qu, Zhi Rong Bis(adamantan-1-aminium) tetrachloridozincate(II) 18-crown-6 monohydrate clathrate Acta Crystallographica Section C 66(8) (2010) m215-m217
Space group: P b c n
Cell volume: 7737
Cell parameters: 26.9702; 11.4912; 24.9646; 90; 90; 90;  

COD ID: 2017757
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 Cu5 I6 P -
Comments: Jalilian, Ehsan; Lidin, Sven Poly[dimethyldiphenylphosphonium [di-μ~4~-iodido-tetra-μ~3~-iodido-pentacopper(I)]] Acta Crystallographica Section C 66(8) (2010) m227-m230
Space group: A m a 2
Cell volume: 2510.7
Cell parameters: 18.211; 23.6861; 5.8206; 90; 90; 90;  

COD ID: 2017758
CIF file

HKL data

Original IUCr paper

Formula: - C10 H12 N4 O4 -
Comments: Sridhar, Balasubramanian; Ravikumar, Krishnan Supramolecular hydrogen-bonded networks in cytosinium nicotinate monohydrate and cytosinium isonicotinate cytosine dihydrate Acta Crystallographica Section C 66(8) (2010) o414-o417
Space group: P 1 21/n 1
Cell volume: 1123.03
Cell parameters: 7.5314; 18.271; 8.4249; 90; 104.374; 90;  

COD ID: 2017759
CIF file

HKL data

Original IUCr paper

Formula: - C14 H19 N7 O6 -
Comments: Sridhar, Balasubramanian; Ravikumar, Krishnan Supramolecular hydrogen-bonded networks in cytosinium nicotinate monohydrate and cytosinium isonicotinate cytosine dihydrate Acta Crystallographica Section C 66(8) (2010) o414-o417
Space group: P -1
Cell volume: 874.7
Cell parameters: 7.1852; 7.3627; 17.7387; 99.831; 92.928; 107.862;  

COD ID: 2017760
CIF file

HKL data

Original IUCr paper

Formula: - C11 H9 F N2 O -
Comments: Langer, Vratislav; Mach, Pavol; Smrčok, Ľubomír; Milata, Viktor; Plevová, Kristína 2-{[(3-Fluorophenyl)amino]methylidene}-3-oxobutanenitrile and 5-{[(3-fluorophenyl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione: X-ray and DFT studies Acta Crystallographica Section C 66(8) (2010) o392-o395
Space group: P 1 21/n 1
Cell volume: 942.8
Cell parameters: 13.907; 5.0357; 14.233; 90; 108.946; 90;  


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