Crystallography Open Database

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2017461 CIF
HKL
Paper
Co1.97 Li4.03 O14 P4P 1 21/a 19.817; 9.741; 11.012
90; 101.76; 90
1030.9Kouass, 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, 2010, 66, i4-i6
2017462 CIF
HKL
Paper
C5 H13 K N2 O9 P2P -16.961; 7.038; 13.322
94.82; 103.75; 92.58
630.3Freire, 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, 2010, 66, m13-m16
2017463 CIF
Paper
C9 H12 Cl N3 O4P b c a6.7339; 15.469; 21.327
90; 90; 90
2221.6Brüning, 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, 2010, 66, o1-o4
2017464 CIF
HKL
Paper
C13 H26 N2 O13P 21 21 217.5571; 7.7903; 29.8324
90; 90; 90
1756.3Katagiri, 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, 2010, 66, o20-o24
2017465 CIF
HKL
Paper
C13 H26 N2 O13P 21 21 217.6062; 7.6426; 30.3987
90; 90; 90
1767.11Katagiri, 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, 2010, 66, o20-o24
2017466 CIF
HKL
Paper
C15 H15 N3 O2P 1 21/c 110.4969; 9.855; 12.6739
90; 99.883; 90
1291.6Quiroga, 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, 2010, 66, o25-o28
2017467 CIF
HKL
Paper
C20 H26 N6 O4P -18.0402; 8.2025; 15.348
91.999; 99.785; 99.172
982.7Quiroga, 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, 2010, 66, o25-o28
2017468 CIF
HKL
Paper
C18 H19 N5 O3P -17.9772; 10.0023; 10.8409
93.693; 93.562; 99.196
849.8Quiroga, 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, 2010, 66, o39-o43
2017469 CIF
HKL
Paper
C12 H15 N5 O3P -18.152; 9.2984; 9.7299
69.609; 70.741; 79.447
650.69Quiroga, 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, 2010, 66, o39-o43
2017470 CIF
HKL
Paper
C6 H6 F6 Mn N2 O6 S2P -15.13763; 8.1188; 9.75293
73.126; 76.885; 76.025
372.346Lutz, 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, 2010, 66, m9-m12
2017471 CIF
HKL
Paper
B14 Ba7 F5 K Mg2 O28C 1 2/c 116.638; 13.609; 15.214
90; 121.309; 90
2943.2Li, 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, 2010, 66, i7-i8
2017472 CIF
HKL
Paper
C28 H18 N2 O2C 1 2/c 111.2449; 6.0053; 29.0699
90; 96.428; 90
1950.72Fourati, 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, 2010, 66, o11-o14
2017473 CIF
HKL
Paper
C28 H18 N2 O2C 1 2/c 111.3459; 6.0578; 29.6234
90; 95.073; 90
2028.08Fourati, 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, 2010, 66, o11-o14
2017474 CIF
HKL
Paper
C11 H12 N3 O1.5P b c n10.8346; 7.4952; 24.621
90; 90; 90
1999.4Quiroga, 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, 2010, 66, o47-o49
2017475 CIF
HKL
Paper
C18 H20 OP 1 21/n 16.3784; 12.793; 18.014
90; 97.28; 90
1458.1Bakowicz, 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, 2010, 66, o29-o32
2017476 CIF
HKL
Paper
C16 H16 OP c a 2110.7926; 14.931; 7.8275
90; 90; 90
1261.4Bakowicz, 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, 2010, 66, o29-o32
2017477 CIF
HKL
Paper
C23 H30 O2P 1 21/c 19.2288; 12.0541; 18.821
90; 90.021; 90
2093.7Bakowicz, 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, 2010, 66, o29-o32
2017478 CIF
HKL
Paper
C11 H16 N2 O3P -16.416; 7.9559; 11.9569
77.574; 80.837; 75.518
573.51Gelbrich, 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, 2010, 66, o55-o58
2017479 CIF
HKL
Paper
C14 H20 N2 O3P 1 21/n 110.2825; 13.2972; 10.3959
90; 92.999; 90
1419.5Gelbrich, 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, 2010, 66, o55-o58
2017480 CIF
HKL
Paper
C17 H15 N3 S2P 1 21/c 110.696; 9.281; 16.741
90; 110.39; 90
1557.7Rotondo, 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, 2010, 66, o15-o19
2017481 CIF
HKL
Paper
C19 H19 N3 S2P -17.946; 9.842; 12.503
69.829; 75.053; 80.807
884.06Rotondo, 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, 2010, 66, o15-o19
2017482 CIF
HKL
Paper
C19.5 H23 N5 S2P -17.407; 11.1; 12.428
95.91; 99.8; 97.31
990.56Rotondo, 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, 2010, 66, o15-o19
2017483 CIF
HKL
Paper
C22 H25 N3 O5P -19.0227; 10.4548; 13.2014
98.705; 108.738; 111.873
1041.1Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N.
Multicomponent crystals of erlotinib
Acta Crystallographica Section C, 2010, 66, o33-o38
2017484 CIF
HKL
Paper
C46 H48 N6 O12P -17.6285; 10.2252; 14.6525
86.076; 84.925; 70.559
1072.62Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N.
Multicomponent crystals of erlotinib
Acta Crystallographica Section C, 2010, 66, o33-o38
2017485 CIF
HKL
Paper
C24 H29 N3 O8P -17.967; 13.248; 13.745
108.916; 106.673; 101.909
1240.9Sridhar, B.; Ravikumar, K.; Krishnan, Harihara; Singh, A. N.
Multicomponent crystals of erlotinib
Acta Crystallographica Section C, 2010, 66, o33-o38
2017486 CIF
HKL
Paper
C9 H16 N2 O8P 21 21 217.3073; 12.1065; 14.541
90; 90; 90
1286.4Smith, 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, 2010, 66, o5-o10
2017487 CIF
HKL
Paper
C10 H11 N O8P 21 21 216.5792; 7.7637; 21.683
90; 90; 90
1107.54Smith, 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, 2010, 66, o5-o10
2017488 CIF
HKL
Paper
C10 H13 N O9P 21 21 217.1536; 7.8273; 22.0145
90; 90; 90
1232.67Smith, 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, 2010, 66, o5-o10
2017489 CIF
HKL
Paper
C19 H14 N2 O4P -15.7799; 9.9485; 13.0849
83.343; 86.652; 77.128
728.13Abonía, 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, 2010, 66, o44-o46
2017490 CIF
HKL
Paper
C36 H79 Au5 Cl20 N4 O19P 21 21 219.2153; 15.299; 51.544
90; 90; 90
7267Wood, 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, 2010, 66, m4-m8
2017491 CIF
HKL
Paper
C9 H16 Au Cl4 N O3P 21 21 2110.0276; 15.7339; 18.6416
90; 90; 90
2941.15Wood, 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, 2010, 66, m4-m8
2017492 CIF
HKL
Paper
B10 H21 N2 O1.5P 1 21/n 111.674; 8.623; 23.318
90; 98.97; 90
2318.6Yisgedu, 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, 2010, 66, m1-m3
2017493 CIF
HKL
Paper
B2 Cd F K O6 Zn2P -3 1 c5.0381; 5.0381; 15.155
90; 90; 120
333.13Zhang, 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, 2010, 66, i1-i3
2017494 CIF
Paper
C25 H19 N2 PP 1 21/c 18.581; 13.862; 17.17
90; 104.53; 90
1977De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank
Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes
Acta Crystallographica Section C, 2010, 66, o50-o54
2017495 CIF
HKL
Paper
C24 H19 N2 O2 PP 1 21/c 19.118; 17.536; 14.245
90; 117.591; 90
2018.7De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank
Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes
Acta Crystallographica Section C, 2010, 66, o50-o54
2017496 CIF
HKL
Paper
C24 H19 N2 O2 PP -19.001; 9.77; 12.098
84.34; 78.19; 78.41
1018.3De Borger, Roeland; Collas, Alain; Dommisse, Roger; Blockhuys, Frank
Synthesis and structures of substituted triphenyl(phenylimino)phosphoranes
Acta Crystallographica Section C, 2010, 66, o50-o54
2017497 CIF
HKL
Paper
C18 H24 N4 OP b c a13.793; 13.5544; 17.9574
90; 90; 90
3357.2Ravikumar, Krishnan; Sridhar, Balasubramanian
Granisetron, an antiemetic drug, and its cobalt complex
Acta Crystallographica Section C, 2010, 66, m35-m39
2017498 CIF
HKL
Paper
C36 H78 Cl4 Co N8 O16P -19.6311; 9.9794; 16.0133
92.611; 103.449; 118.037
1299.5Ravikumar, Krishnan; Sridhar, Balasubramanian
Granisetron, an antiemetic drug, and its cobalt complex
Acta Crystallographica Section C, 2010, 66, m35-m39
2017499 CIF
HKL
Paper
C20 H16 N4 O3 SP -19.059; 10.238; 10.983
74.18; 76.324; 71.74
917.9Potočňák, 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, 2010, 66, o87-o92
2017500 CIF
HKL
Paper
C18 H14 N4 O SP 1 21 14.7035; 18.5073; 9.1172
90; 102.689; 90
774.26Potočňák, 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, 2010, 66, o87-o92
2017501 CIF
HKL
Paper
C14 H12 N4 SP 1 21/c 18.6535; 18.6374; 7.835
90; 99.372; 90
1246.75Potočňák, 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, 2010, 66, o87-o92
2017502 CIF
HKL
Paper
C14 H4 N2 O8 Pb2C 1 2/c 119.696; 5.3916; 14.209
90; 105.203; 90
1456.1Zhou, 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, 2010, 66, m26-m28
2017503 CIF
HKL
Paper
C2 H5 N5P 317.3048; 7.3048; 6.9003
90; 90; 120
318.87Lyakhov, 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, 2010, 66, m22-m25
2017504 CIF
HKL
Paper
C4 H12 Cu N10 O2P 1 21/c 17.0452; 8.907; 9.059
90; 107.8; 90
541.3Lyakhov, 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, 2010, 66, m22-m25
2017505 CIF
HKL
Paper
C9 H12 I N O11 S UP -18.3742; 10.1785; 11.6146
74.958; 84.717; 66.701
878.04Sasikumar, 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, 2010, 66, m48-m50
2017506 CIF
HKL
Paper
C8 H Cs N4 O2P -15.8737; 9.2927; 9.6759
113.04; 90.834; 100.401
475.9Tafeenko, 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, 2010, 66, m32-m34
2017507 CIF
Paper
C76 H56 Co2 N4 O18P 21 21 210.1264; 28.487; 11.3835
90; 90; 90
3283.8Zhan, 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, 2010, 66, m29-m31
2017508 CIF
HKL
Paper
C18 H28 Cl8 Cu3 N2P 1 21/c 17.4496; 10.0211; 18.4713
90; 99.42; 90
1360.35Bond, 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, 2010, 66, m17-m21
2017509 CIF
HKL
Paper
C28 H34 N4 O2P -15.11; 9.946; 12.107
100.54; 93.9; 103.53
584.2Kuś, 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, 2010, 66, o93-o96
2017510 CIF
HKL
Paper
C28 H34 N4 O2C 1 c 111.5899; 16.7899; 13.4785
90; 114.667; 90
2383.5Kuś, 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, 2010, 66, o93-o96
2017511 CIF
HKL
Paper
C13 H10 N2 OP b c a14.6031; 6.2725; 22.6997
90; 90; 90
2079.25Spencer, 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, 2010, 66, o71-o78
2017512 CIF
HKL
Paper
C13 H9 N O SP b c n11.9297; 10.8294; 16.6986
90; 90; 90
2157.32Spencer, 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, 2010, 66, o71-o78
2017513 CIF
HKL
Paper
C13 H11 N O3P b c n19.225; 5.0503; 22.1886
90; 90; 90
2154.3Spencer, 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, 2010, 66, o71-o78
2017514 CIF
HKL
Paper
C11 H11 N OP -19.7504; 10.2281; 14.053
95.766; 107.842; 96.617
1311.46Spencer, 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, 2010, 66, o71-o78
2017515 CIF
HKL
Paper
C13 H13 N O3P 1 21/n 110.6939; 17.2595; 12.7714
90; 108.322; 90
2237.73Spencer, 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, 2010, 66, o71-o78
2017516 CIF
HKL
Paper
C14 H15 N OP -15.3732; 13.4962; 15.8088
95.389; 98.498; 101.201
1103.32Spencer, 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, 2010, 66, o71-o78
2017517 CIF
HKL
Paper
C11 H11 N O3P 1 21/c 19.5406; 8.4295; 12.4103
90; 101.956; 90
976.42Spencer, 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, 2010, 66, o71-o78
2017518 CIF
HKL
Paper
C13.375 H25.5 O11.375I 420.1789; 20.1789; 8.4712
90; 90; 90
3449.37Hu, 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, 2010, 66, o67-o70
2017519 CIF
HKL
Paper
C22 H16 N4 O2 Pb2 S2P -17.8556; 8.4155; 9.155
78.524; 69.771; 82.813
555.5Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Langer, Vratislav
Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline and thiocyanate
Acta Crystallographica Section C, 2010, 66, m44-m47
2017520 CIF
HKL
Paper
C22 H16 N4 O2 Pb2 S2P 1 21/c 112.037; 5.731; 16.327
90; 90.368; 90
1126.3Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Langer, Vratislav
Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline and thiocyanate
Acta Crystallographica Section C, 2010, 66, m44-m47
2017521 CIF
HKL
Paper
C18 H36 Cl2 N2 O6 SP 1 21 19.4669; 9.9255; 13.4949
90; 104.601; 90
1227.08Ravikumar, Krishnan; Sridhar, Balasubramanian
Clindamycin hydrochloride monohydrate and its ethanol solvate
Acta Crystallographica Section C, 2010, 66, o97-o100
2017522 CIF
HKL
Paper
C20 H42 Cl2 N2 O7 SP 21 21 219.963; 10.6998; 26.324
90; 90; 90
2806.2Ravikumar, Krishnan; Sridhar, Balasubramanian
Clindamycin hydrochloride monohydrate and its ethanol solvate
Acta Crystallographica Section C, 2010, 66, o97-o100
2017523 CIF
HKL
Paper
C23 H27 N3 O2P -19.8325; 9.8649; 12.0365
97.468; 95.512; 114.643
1037.44Castillo, 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, 2010, 66, o64-o66
2017524 CIF
HKL
Paper
Cs2 O21 P4 V3P 1 21/c 112.5465; 11.9181; 12.6531
90; 96.7859; 90
1878.77Gautier, 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, 2010, 66, i12-i15
2017525 CIF
HKL
Paper
Cs2 O11 P2 V2P 1 21/c 18.918; 16.9479; 7.2199
90; 99.092; 90
1077.52Gautier, 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, 2010, 66, i12-i15
2017526 CIF
HKL
Paper
H3 Nd O9 S2P 1 21/c 18.8593; 7.1787; 10.7955
90; 91.671; 90
686.28Zhang, Zaichao; Zhang, Zhibin
(H~3~O)Nd(SO~4~)~2~
Acta Crystallographica Section C, 2010, 66, i9-i11
2017527 CIF
Paper
F8 K3 TaP 63 m c8.2533; 8.2533; 6.3196
90; 90; 120
372.8Smrčok, Ľubomír; Černý, Radovan; Boča, Miroslav; Macková, Iveta; Kubíková, Blanka
K~3~TaF~8~ from laboratory X-ray powder data
Acta Crystallographica Section C, 2010, 66, i16-i18
2017528 CIF
HKL
Paper
C7 H15 Au Cl4 N2 O4 SP -17.625; 10.2576; 10.716
95.281; 107.222; 92.001
795.46Rychlewska, 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, 2010, 66, m51-m54
2017529 CIF
HKL
Paper
C16 H13 N O3P 1 21/c 113.876; 5.7725; 16.28
90; 107.799; 90
1241.6Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017530 CIF
HKL
Paper
C17 H15 N O3P -16.873; 7.67; 13.394
99.48; 101.68; 96.33
674.4Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017531 CIF
HKL
Paper
C16 H12 F N O3P -16.8858; 7.7074; 12.701
98.229; 103.667; 96.034
641.43Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017532 CIF
HKL
Paper
C16 H12 Cl N O3P -16.987; 7.689; 12.907
99.3; 101.82; 96.33
662.4Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017533 CIF
HKL
Paper
C16 H12 Br N O3P -17.016; 7.7349; 13.052
99.69; 101.51; 96.7
675.8Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017534 CIF
HKL
Paper
C16 H12 N2 O5P -17.026; 7.598; 13.365
97.54; 102.67; 96.46
682.7Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017535 CIF
HKL
Paper
C14 H11 N O3 SP -16.5958; 7.9577; 12.045
78.51; 76.555; 84.559
601.8Becerra, Diana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in 3-alkyl-3-hydroxyindolin-2-ones
Acta Crystallographica Section C, 2010, 66, o79-o86
2017536 CIF
HKL
Paper
C59 H73 Cl6 Co N3 O14 P2P 1 21/n 112.3461; 19.7566; 28.4452
90; 92.818; 90
6929.9Becker, 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, 2010, 66, m40-m43
2017537 CIF
HKL
Paper
C59 H73 Cl5 Co N3 O10 P2P 63/m21.7568; 21.7568; 23.3983
90; 90; 120
9591.9Becker, 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, 2010, 66, m40-m43
2017538 CIF
HKL
Paper
C38 H34 O10P 1 21/c 19.734; 15.993; 10.827
90; 107.488; 90
1607.6Mehta, 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, 2010, 66, o59-o63
2017539 CIF
HKL
Paper
C14 H22 O6P 1 21/n 19.888; 14.747; 10.417
90; 110.444; 90
1423.3Mehta, 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, 2010, 66, o59-o63
2017540 CIF
HKL
Paper
C24 H26 O6P 1 21/c 116.246; 11.167; 11.829
90; 92.219; 90
2144.4Mehta, 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, 2010, 66, o59-o63
2017541 CIF
HKL
Paper
C10 H8 Cl2 N2 O5P 1 21/c 112.6621; 3.75947; 26.7435
90; 114.208; 90
1161.12Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki
Two solid phases of pyrimidin-1-ium hydrogen chloranilate monohydrate determined at 225 and 120K
Acta Crystallographica Section C, 2010, 66, o114-o118
2017542 CIF
HKL
Paper
C10 H8 Cl2 N2 O5P 1 21/n 125.5952; 3.71581; 26.3761
90; 114.529; 90
2282.16Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki
Two solid phases of pyrimidin-1-ium hydrogen chloranilate monohydrate determined at 225 and 120K
Acta Crystallographica Section C, 2010, 66, o114-o118
2017543 CIF
HKL
Paper
C17 H16 N O0.42 PP 1 21/c 19.6282; 15.2848; 20.391
90; 101.376; 90
2941.9Broomfield, 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, 2010, 66, m79-m82
2017544 CIF
HKL
Paper
C17 H16 Cl4 N P TiP -18.1481; 8.6323; 14.202
98.159; 98.727; 100.588
955.6Broomfield, 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, 2010, 66, m79-m82
2017545 CIF
HKL
Paper
C O3 Tl2C 1 2/m 112.02; 5.15; 7.198
90; 122.08; 90
377.5Grzechnik, A.; Friese, K.
Crystal structure and stability of Tl~2~CO~3~ at high pressures
Acta Crystallographica Section C, 2010, 66, i37-i38
2017546 CIF
HKL
Paper
C10 H11 N O2 SP n a 219.9418; 9.3619; 10.9337
90; 90; 90
1017.64Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates
Acta Crystallographica Section C, 2010, 66, o141-o146
2017547 CIF
HKL
Paper
C11 H13 N O2 SP 1 21/c 112.2845; 9.1431; 9.7897
90; 90.182; 90
1099.6Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates
Acta Crystallographica Section C, 2010, 66, o141-o146
2017548 CIF
HKL
Paper
C13 H17 N O2 SP -17.247; 8.887; 10.737
100.691; 99.984; 107.307
629.19Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates
Acta Crystallographica Section C, 2010, 66, o141-o146
2017549 CIF
HKL
Paper
C12 H14 Cl N O2 SP -17.8028; 9.48; 9.86
69.545; 75.683; 69.548
633.7Insuasty, Henry; Castro, Edison; Sánchez, Edison; Cobo, Justo; Glidewell, Christopher
Hydrogen-bonding patterns in two aroylthiocarbamates and two aroylimidothiocarbonates
Acta Crystallographica Section C, 2010, 66, o141-o146
2017550 CIF
HKL
Paper
C60 H96 N4 O10 Sn4P 1 21/c 112.3017; 17.1436; 15.8633
90; 103.301; 90
3255.75Linden, Anthony; Basu Baul, Tushar S.; Das, Pradip
Tetrakis(μ~2~-4-aminobenzoato)di-μ~3~-oxido-tetrakis[dibutyltin(IV)]
Acta Crystallographica Section C, 2010, 66, m58-m61
2017551 CIF
HKL
Paper
C6 H12 N2 O2P n m a8.8599; 15.0248; 5.8952
90; 90; 90
784.76Czapik, 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, 2010, 66, o128-o132
2017552 CIF
HKL
Paper
C6 H8 N2P 1 21/c 18.302; 5.897; 22.76
90; 93.579; 90
1112.09Czapik, 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, 2010, 66, o128-o132
2017553 CIF
HKL
Paper
C16 H44 Cu Na2 O16P -18.7666; 9.5089; 9.7804
99.152; 101.983; 113.91
701.61Rivers, 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, 2010, 66, m83-m85
2017554 CIF
HKL
Paper
Al0.19 Fe0.81 H6 O12 P3C 1 c 111.7; 15.59; 5.03
90; 98; 90
908.6Belfguira, 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, 2010, 66, i33-i36
2017555 CIF
HKL
Paper
La2 Pb S8 Si2R -3 c :H9.0522; 9.0522; 26.964
90; 90; 120
1913.5Gulay, L. D.; Daszkiewicz, M.; Ruda, I. P.; Marchuk, O. V.
La~2~Pb(SiS~4~)~2~
Acta Crystallographica Section C, 2010, 66, i19-i21
2017556 CIF
HKL
Paper
C20 H21 Cl N4 O2C 1 2/c 117.1373; 16.4776; 16.6127
90; 119.08; 90
4099.77Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas
Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate
Acta Crystallographica Section C, 2010, 66, o104-o108
2017557 CIF
HKL
Paper
C18 H18 Cl N5 O3P 1 21/c 111.2563; 14.3968; 11.7902
90; 103.625; 90
1856.89Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas
Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate
Acta Crystallographica Section C, 2010, 66, o104-o108
2017558 CIF
HKL
Paper
C19 H17 Cl3 N4 O2P b c a14.3808; 12.6799; 22.4021
90; 90; 90
4084.96Thanigaimani, Kaliyaperumal; Muthiah, Packianathan Thomas
Hydrogen-bonded supramolecular motifs in pyrimethaminium 4-methylbenzoate, pyrimethaminium 3-hydroxypicolinate and pyrimethaminium 2,4-dichlorobenzoate
Acta Crystallographica Section C, 2010, 66, o104-o108
2017559 CIF
HKL
Paper
C6 H9 Cl N O4 PP 1 21/n 111.3143; 4.7466; 17.5024
90; 108.54; 90
891.17Balamurugan, P.; Jagan, R.; Sivakumar, K.
Dihydrogen phosphate mediated supramolecular frameworks in 2- and 4-chloroanilinium dihydrogen phosphate salts
Acta Crystallographica Section C, 2010, 66, o109-o113
2017560 CIF
HKL
Paper
C6 H9 Cl N O4 PP b c a9.7371; 7.8756; 25.141
90; 90; 90
1928Balamurugan, P.; Jagan, R.; Sivakumar, K.
Dihydrogen phosphate mediated supramolecular frameworks in 2- and 4-chloroanilinium dihydrogen phosphate salts
Acta Crystallographica Section C, 2010, 66, o109-o113

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